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Secondary amines

Organic compounds and functional groups that contain a basic nitrogen atom with a lone pair. Secondary amines have a nitrogen atom bonded to one hydrogen atom, and two carbon atoms or other functional groups.

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1

Dimethylamine, 40% w/w aq. soln., Thermo Scientific Chemicals

CAS: 124-40-3 Molecular Formula: C2H7N Molecular Weight (g/mol): 45.085 MDL Number: MFCD00008288 InChI Key: ROSDSFDQCJNGOL-UHFFFAOYSA-N Synonym: dimethylamine,n,n-dimethylamine,methanamine, n-methyl,dimethylamin,dimethyl amine,dimethyl-amine,dimethylamine anhydrous,rcra waste number u092,dimethylamine solution PubChem CID: 674 ChEBI: CHEBI:17170 IUPAC Name: N-methylmethanamine SMILES: CNC

PubChem CID 674
CAS 124-40-3
Molecular Weight (g/mol) 45.085
ChEBI CHEBI:17170
MDL Number MFCD00008288
SMILES CNC
Synonym dimethylamine,n,n-dimethylamine,methanamine, n-methyl,dimethylamin,dimethyl amine,dimethyl-amine,dimethylamine anhydrous,rcra waste number u092,dimethylamine solution
IUPAC Name N-methylmethanamine
InChI Key ROSDSFDQCJNGOL-UHFFFAOYSA-N
Molecular Formula C2H7N
2

N-Methylisobutylamine, 98+%

CAS: 625-43-4 Molecular Formula: C5H13N Molecular Weight (g/mol): 87.166 MDL Number: MFCD00015043 InChI Key: QKYWADPCTHTJHQ-UHFFFAOYSA-N Synonym: n-methylisobutylamine,1-propanamine, n,2-dimethyl,n,2-dimethylpropylamine,n-isobutylmethylamine,methyl 2-methylpropyl amine,isobutylmethylamine,methylisobutylamine,propylamine, n,2-dimethyl,n-isobutyl-n-methylamine,methyl-isobutyl-amin PubChem CID: 12249 IUPAC Name: N,2-dimethylpropan-1-amine SMILES: CC(C)CNC

PubChem CID 12249
CAS 625-43-4
Molecular Weight (g/mol) 87.166
MDL Number MFCD00015043
SMILES CC(C)CNC
Synonym n-methylisobutylamine,1-propanamine, n,2-dimethyl,n,2-dimethylpropylamine,n-isobutylmethylamine,methyl 2-methylpropyl amine,isobutylmethylamine,methylisobutylamine,propylamine, n,2-dimethyl,n-isobutyl-n-methylamine,methyl-isobutyl-amin
IUPAC Name N,2-dimethylpropan-1-amine
InChI Key QKYWADPCTHTJHQ-UHFFFAOYSA-N
Molecular Formula C5H13N
3

Spermidine, 99%

CAS: 124-20-9 Molecular Formula: C7H19N3 Molecular Weight (g/mol): 145.25 MDL Number: MFCD00008229 InChI Key: ATHGHQPFGPMSJY-UHFFFAOYSA-N Synonym: spermidine,1,5,10-triazadecane,4-azaoctamethylenediamine,spermidin,4-azaoctane-1,8-diamine,n1-3-aminopropyl butane-1,4-diamine,1,4-butanediamine, n-3-aminopropyl,n-3-aminopropyl butane-1,4-diamine,n-3-aminopropyl-1,4-butane-diamine,1,4-diaminobutane, n-3-aminopropyl PubChem CID: 1102 ChEBI: CHEBI:16610 IUPAC Name: N'-(3-aminopropyl)butane-1,4-diamine SMILES: NCCCCNCCCN

PubChem CID 1102
CAS 124-20-9
Molecular Weight (g/mol) 145.25
ChEBI CHEBI:16610
MDL Number MFCD00008229
SMILES NCCCCNCCCN
Synonym spermidine,1,5,10-triazadecane,4-azaoctamethylenediamine,spermidin,4-azaoctane-1,8-diamine,n1-3-aminopropyl butane-1,4-diamine,1,4-butanediamine, n-3-aminopropyl,n-3-aminopropyl butane-1,4-diamine,n-3-aminopropyl-1,4-butane-diamine,1,4-diaminobutane, n-3-aminopropyl
IUPAC Name N'-(3-aminopropyl)butane-1,4-diamine
InChI Key ATHGHQPFGPMSJY-UHFFFAOYSA-N
Molecular Formula C7H19N3
4

N-Dodecylmethylamine, 98%

CAS: 7311-30-0 Molecular Formula: C13H29N Molecular Weight (g/mol): 199.382 MDL Number: MFCD00026574 InChI Key: OMEMQVZNTDHENJ-UHFFFAOYSA-N Synonym: n-methyldodecylamine,dodecyl methyl amine,dodecylmethylamine,1-dodecanamine, n-methyl,n-dodecylmethylamine,dodecyl-methyl-amine,unii-88nn43i94s,methyldodecylamine,n-methyldodecanamine,n-methyl-n-dodecylamine PubChem CID: 81746 IUPAC Name: N-methyldodecan-1-amine SMILES: CCCCCCCCCCCCNC

PubChem CID 81746
CAS 7311-30-0
Molecular Weight (g/mol) 199.382
MDL Number MFCD00026574
SMILES CCCCCCCCCCCCNC
Synonym n-methyldodecylamine,dodecyl methyl amine,dodecylmethylamine,1-dodecanamine, n-methyl,n-dodecylmethylamine,dodecyl-methyl-amine,unii-88nn43i94s,methyldodecylamine,n-methyldodecanamine,n-methyl-n-dodecylamine
IUPAC Name N-methyldodecan-1-amine
InChI Key OMEMQVZNTDHENJ-UHFFFAOYSA-N
Molecular Formula C13H29N
5

2-Methylpyrrolidine, 97%

CAS: 765-38-8 Molecular Formula: C5H11N Molecular Weight (g/mol): 85.15 MDL Number: MFCD00014491 InChI Key: RGHPCLZJAFCTIK-UHFFFAOYSA-N PubChem CID: 13003 IUPAC Name: 2-methylpyrrolidine SMILES: CC1CCCN1

PubChem CID 13003
CAS 765-38-8
Molecular Weight (g/mol) 85.15
MDL Number MFCD00014491
SMILES CC1CCCN1
IUPAC Name 2-methylpyrrolidine
InChI Key RGHPCLZJAFCTIK-UHFFFAOYSA-N
Molecular Formula C5H11N
6

N-Ethylpropylamine, 97+%

CAS: 20193-20-8 Molecular Formula: C5H13N Molecular Weight (g/mol): 87.166 MDL Number: MFCD00015198 InChI Key: XCVNDBIXFPGMIW-UHFFFAOYSA-N Synonym: n-ethylpropylamine,1-propanamine, n-ethyl,ethyl propyl amine,propylamine, n-ethyl,ethylpropylamine,n-ethyl-n-propylamine,ethyl-propyl-amine,n-propylethylamine,n-ethylpropanamine,ethyl-n-propylamine PubChem CID: 88398 IUPAC Name: N-ethylpropan-1-amine SMILES: CCCNCC

PubChem CID 88398
CAS 20193-20-8
Molecular Weight (g/mol) 87.166
MDL Number MFCD00015198
SMILES CCCNCC
Synonym n-ethylpropylamine,1-propanamine, n-ethyl,ethyl propyl amine,propylamine, n-ethyl,ethylpropylamine,n-ethyl-n-propylamine,ethyl-propyl-amine,n-propylethylamine,n-ethylpropanamine,ethyl-n-propylamine
IUPAC Name N-ethylpropan-1-amine
InChI Key XCVNDBIXFPGMIW-UHFFFAOYSA-N
Molecular Formula C5H13N
7
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Spermidine trihydrochloride, MP Biomedicals™

CAS: 334-50-9 Molecular Formula: C7H22Cl3N3 Molecular Weight (g/mol): 254.62 MDL Number: MFCD00012918 InChI Key: LCNBIHVSOPXFMR-UHFFFAOYSA-N Synonym: spermidine trihydrochloride,n-3-aminopropyl-1,4-butanediamine trihydrochloride,spermidine hydrochloride,n1-3-aminopropyl butane-1,4-diamine trihydrochloride,unii-1o14bed398,1,4-butanediamine, n-3-aminopropyl-, trihydrochloride,spermidine, trihydrochloride,1,4-butanediamine, n-3-aminopropyl , hydrochloride,n-3-aminopropyl butane-1,4-diamine trihydrochloride,4-azoniaoctamethylenediammonium trichloride PubChem CID: 9539 SMILES: [H+].[H+].[H+].[Cl-].[Cl-].[Cl-].NCCCCNCCCN

PubChem CID 9539
CAS 334-50-9
Molecular Weight (g/mol) 254.62
MDL Number MFCD00012918
SMILES [H+].[H+].[H+].[Cl-].[Cl-].[Cl-].NCCCCNCCCN
Synonym spermidine trihydrochloride,n-3-aminopropyl-1,4-butanediamine trihydrochloride,spermidine hydrochloride,n1-3-aminopropyl butane-1,4-diamine trihydrochloride,unii-1o14bed398,1,4-butanediamine, n-3-aminopropyl-, trihydrochloride,spermidine, trihydrochloride,1,4-butanediamine, n-3-aminopropyl , hydrochloride,n-3-aminopropyl butane-1,4-diamine trihydrochloride,4-azoniaoctamethylenediammonium trichloride
InChI Key LCNBIHVSOPXFMR-UHFFFAOYSA-N
Molecular Formula C7H22Cl3N3
8

L-(-)-Prolinamide, 98%

CAS: 7531-52-4 Molecular Formula: C5H11N2O Molecular Weight (g/mol): 115.16 MDL Number: MFCD00005253 InChI Key: VLJNHYLEOZPXFW-BYPYZUCNSA-O Synonym: l-prolinamide,prolinamide,h-pro-nh2,s-pyrrolidine-2-carboxamide,s-prolinamide,2s-pyrrolidine-2-carboxamide,l-prolineamide,l-proline amide,l---prolinamide,s-2-pyrrolidinecarboxamide PubChem CID: 111306 ChEBI: CHEBI:21374 SMILES: NC(=O)[C@@H]1CCC[NH2+]1

PubChem CID 111306
CAS 7531-52-4
Molecular Weight (g/mol) 115.16
ChEBI CHEBI:21374
MDL Number MFCD00005253
SMILES NC(=O)[C@@H]1CCC[NH2+]1
Synonym l-prolinamide,prolinamide,h-pro-nh2,s-pyrrolidine-2-carboxamide,s-prolinamide,2s-pyrrolidine-2-carboxamide,l-prolineamide,l-proline amide,l---prolinamide,s-2-pyrrolidinecarboxamide
InChI Key VLJNHYLEOZPXFW-BYPYZUCNSA-O
Molecular Formula C5H11N2O
9

Thermo Scientific Chemicals N-Methyl-beta-alaninenitrile, 98%

CAS: 693-05-0 Molecular Formula: C4H8N2 Molecular Weight (g/mol): 84.12 MDL Number: MFCD00001954 InChI Key: UNIJBMUBHBAUET-UHFFFAOYSA-N Synonym: 3-methylamino propanenitrile,3-methylaminopropionitrile,3-methylamino propionitrile,propanenitrile, 3-methylamino,2-cyanoethyl methyl amine,propionitrile, 3-methylamino,n-2-cyanoethyl methylamine,3-n-methylamino propionitrile,2-cyanoethyl methylamine,n-methyl-beta-alaninenitrile PubChem CID: 69656 IUPAC Name: 3-(methylamino)propanenitrile SMILES: CNCCC#N

PubChem CID 69656
CAS 693-05-0
Molecular Weight (g/mol) 84.12
MDL Number MFCD00001954
SMILES CNCCC#N
Synonym 3-methylamino propanenitrile,3-methylaminopropionitrile,3-methylamino propionitrile,propanenitrile, 3-methylamino,2-cyanoethyl methyl amine,propionitrile, 3-methylamino,n-2-cyanoethyl methylamine,3-n-methylamino propionitrile,2-cyanoethyl methylamine,n-methyl-beta-alaninenitrile
IUPAC Name 3-(methylamino)propanenitrile
InChI Key UNIJBMUBHBAUET-UHFFFAOYSA-N
Molecular Formula C4H8N2
10

7-(Trifluoromethyl)-1,2,3,4-tetrahydroquinoline, 97%

CAS: 450-62-4 Molecular Formula: C10H10F3N Molecular Weight (g/mol): 201.192 MDL Number: MFCD00079784 InChI Key: RGZZKZNESVFQKR-UHFFFAOYSA-N Synonym: 7-trifluoromethyl-1,2,3,4-tetrahydroquinoline,7-trifluoromethyl-1,2,3,4-tetrahydro-quinoline,quinoline, 1,2,3,4-tetrahydro-7-trifluoromethyl,pubchem7221,acmc-20aip4 PubChem CID: 2781139 IUPAC Name: 7-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline SMILES: C1CC2=C(C=C(C=C2)C(F)(F)F)NC1

PubChem CID 2781139
CAS 450-62-4
Molecular Weight (g/mol) 201.192
MDL Number MFCD00079784
SMILES C1CC2=C(C=C(C=C2)C(F)(F)F)NC1
Synonym 7-trifluoromethyl-1,2,3,4-tetrahydroquinoline,7-trifluoromethyl-1,2,3,4-tetrahydro-quinoline,quinoline, 1,2,3,4-tetrahydro-7-trifluoromethyl,pubchem7221,acmc-20aip4
IUPAC Name 7-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
InChI Key RGZZKZNESVFQKR-UHFFFAOYSA-N
Molecular Formula C10H10F3N
11

(S)-(+)-2-(Anilinomethyl)pyrrolidine, 95%, Thermo Scientific™

CAS: 64030-44-0 Molecular Formula: C11H16N2 Molecular Weight (g/mol): 176.26 InChI Key: MCHWKJRTMPIHRA-NSHDSACASA-N Synonym: s-+-2-anilinomethyl pyrrolidine,s-n-pyrrolidin-2-ylmethyl aniline,s-2-anilinomethyl pyrrolidine,s-+-n-2-pyrrolidinomethyl aniline,s-phenyl-pyrrolidin-2-ylmethyl-amine,n-2s-pyrrolidin-2-ylmethyl aniline,pubchem8116,2s-2-anilinomethyl pyrrolidine,s-2-phenylaminomethyl-pyrrolidine,n-2s-pyrrolidin-2-yl methyl aniline PubChem CID: 6950385 IUPAC Name: N-[[(2S)-pyrrolidin-2-yl]methyl]aniline SMILES: C1CC(NC1)CNC2=CC=CC=C2

PubChem CID 6950385
CAS 64030-44-0
Molecular Weight (g/mol) 176.26
SMILES C1CC(NC1)CNC2=CC=CC=C2
Synonym s-+-2-anilinomethyl pyrrolidine,s-n-pyrrolidin-2-ylmethyl aniline,s-2-anilinomethyl pyrrolidine,s-+-n-2-pyrrolidinomethyl aniline,s-phenyl-pyrrolidin-2-ylmethyl-amine,n-2s-pyrrolidin-2-ylmethyl aniline,pubchem8116,2s-2-anilinomethyl pyrrolidine,s-2-phenylaminomethyl-pyrrolidine,n-2s-pyrrolidin-2-yl methyl aniline
IUPAC Name N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
InChI Key MCHWKJRTMPIHRA-NSHDSACASA-N
Molecular Formula C11H16N2
12

4-Bromo-N-(4-methoxybenzyl)aniline, 97%, Thermo Scientific Chemicals

CAS: 175357-73-0 Molecular Formula: C14H14BrNO Molecular Weight (g/mol): 292.176 MDL Number: MFCD00017822 InChI Key: LJKLYFDMLGYRCA-UHFFFAOYSA-N Synonym: 4-bromo-n-4-methoxyphenyl methyl aniline,4-bromo-n-4-methoxybenzyl aniline,n-4-methoxybenzyl-4-bromoaniline,4-bromo-phenyl-4-methoxy-benzyl-amine,4-bromophenyl 4-methoxyphenyl methyl amine PubChem CID: 775227 IUPAC Name: 4-bromo-N-[(4-methoxyphenyl)methyl]aniline SMILES: COC1=CC=C(C=C1)CNC2=CC=C(C=C2)Br

PubChem CID 775227
CAS 175357-73-0
Molecular Weight (g/mol) 292.176
MDL Number MFCD00017822
SMILES COC1=CC=C(C=C1)CNC2=CC=C(C=C2)Br
Synonym 4-bromo-n-4-methoxyphenyl methyl aniline,4-bromo-n-4-methoxybenzyl aniline,n-4-methoxybenzyl-4-bromoaniline,4-bromo-phenyl-4-methoxy-benzyl-amine,4-bromophenyl 4-methoxyphenyl methyl amine
IUPAC Name 4-bromo-N-[(4-methoxyphenyl)methyl]aniline
InChI Key LJKLYFDMLGYRCA-UHFFFAOYSA-N
Molecular Formula C14H14BrNO
13

6-Methyl-1,2,3,4-tetrahydroquinoline, 98%

CAS: 91-61-2 Molecular Formula: C10H13N Molecular Weight (g/mol): 147.22 MDL Number: MFCD00023887 InChI Key: XOKMRXSMOHCNIX-UHFFFAOYSA-N Synonym: civettal,1,2,3,4-tetrahydro-6-methylquinoline,quinoline, 1,2,3,4-tetrahydro-6-methyl,quinoline, tetrahydro-6-methyl,p-methyltetrahydroquinoline,acmc-209rck,dsstox_cid_27444,dsstox_rid_82351,dsstox_gsid_47444,xokmrxsmohcnix-uhfffaoysa PubChem CID: 66678 IUPAC Name: 6-methyl-1,2,3,4-tetrahydroquinoline SMILES: CC1=CC=C2NCCCC2=C1

PubChem CID 66678
CAS 91-61-2
Molecular Weight (g/mol) 147.22
MDL Number MFCD00023887
SMILES CC1=CC=C2NCCCC2=C1
Synonym civettal,1,2,3,4-tetrahydro-6-methylquinoline,quinoline, 1,2,3,4-tetrahydro-6-methyl,quinoline, tetrahydro-6-methyl,p-methyltetrahydroquinoline,acmc-209rck,dsstox_cid_27444,dsstox_rid_82351,dsstox_gsid_47444,xokmrxsmohcnix-uhfffaoysa
IUPAC Name 6-methyl-1,2,3,4-tetrahydroquinoline
InChI Key XOKMRXSMOHCNIX-UHFFFAOYSA-N
Molecular Formula C10H13N
14

5-Bromoindoline, 98+%

CAS: 22190-33-6 Molecular Formula: C8H8BrN Molecular Weight (g/mol): 198.063 MDL Number: MFCD00027410 InChI Key: QEDCHCLHHGGYBT-UHFFFAOYSA-N Synonym: 5-bromoindoline,1h-indole, 5-bromo-2,3-dihydro,5-bromo-indoline,zlchem 28,5-bromodihydroindole,pubchem7319,acmc-1cez6,5-bromo-2,3-dihydro-indole,ksc497i6r PubChem CID: 3411566 IUPAC Name: 5-bromo-2,3-dihydro-1H-indole SMILES: C1CNC2=C1C=C(C=C2)Br

PubChem CID 3411566
CAS 22190-33-6
Molecular Weight (g/mol) 198.063
MDL Number MFCD00027410
SMILES C1CNC2=C1C=C(C=C2)Br
Synonym 5-bromoindoline,1h-indole, 5-bromo-2,3-dihydro,5-bromo-indoline,zlchem 28,5-bromodihydroindole,pubchem7319,acmc-1cez6,5-bromo-2,3-dihydro-indole,ksc497i6r
IUPAC Name 5-bromo-2,3-dihydro-1H-indole
InChI Key QEDCHCLHHGGYBT-UHFFFAOYSA-N
Molecular Formula C8H8BrN
15

1,10-Diaza-18-crown-6, 96%

CAS: 23978-55-4 Molecular Formula: C12H28N2O4 Molecular Weight (g/mol): 264.37 MDL Number: MFCD00005112 InChI Key: NLMDJJTUQPXZFG-UHFFFAOYSA-P Synonym: kryptofix 22,cryptand 2.2,cryptand 22,diaza-18-crown-6,1,7,10,16-tetraoxa-4,13-diazacyclooctadecane,7,16-diaza-18-crown-6,unii-xly51t1rsz,xly51t1rsz,1,10-diaza-4,7,13,16-tetraoxacyclooctadecane,7,16-diaza-1,4,10,13-tetraoxcyclooctadecane PubChem CID: 72805 IUPAC Name: 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane SMILES: C1COCCOCC[NH2+]CCOCCOCC[NH2+]1

PubChem CID 72805
CAS 23978-55-4
Molecular Weight (g/mol) 264.37
MDL Number MFCD00005112
SMILES C1COCCOCC[NH2+]CCOCCOCC[NH2+]1
Synonym kryptofix 22,cryptand 2.2,cryptand 22,diaza-18-crown-6,1,7,10,16-tetraoxa-4,13-diazacyclooctadecane,7,16-diaza-18-crown-6,unii-xly51t1rsz,xly51t1rsz,1,10-diaza-4,7,13,16-tetraoxacyclooctadecane,7,16-diaza-1,4,10,13-tetraoxcyclooctadecane
IUPAC Name 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
InChI Key NLMDJJTUQPXZFG-UHFFFAOYSA-P
Molecular Formula C12H28N2O4