N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine

C101H153ClN18O3 — CID 157259125

IUPACN-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine
SMILESCC(C)N(C)Cc1cn2ccccc2n1.CC(C)N(CCN1CCOCC1)Cc1cccnc1.CC(C)NC(C)c1ccc(-n2ccnc2)cc1.CC(C)NCC(c1ccccc1)N1CCOCC1.CC(C)NCC(c1ccccc1Cl)N1CCOCC1.CC(C)N[C@@H](CN1CCC1)c1ccccc1.Cc1ccccc1-n1nc(C)c(CNC(C)C)c1C
InChIInChI=1S/C16H23N3.C15H23ClN2O.C15H25N3O.C15H24N2O.C14H19N3.C14H22N2.C12H17N3/c1-11(2)17-10-15-13(4)18-19(14(15)5)16-9-7-6-8-12(16)3;1-12(2)17-11-15(18-7-9-19-10-8-18)13-5-3-4-6-14(13)16;1-14(2)18(13-15-4-3-5-16-12-15)7-6-17-8-10-19-11-9-17;1-13(2)16-12-15(14-6-4-3-5-7-14)17-8-10-18-11-9-17;1-11(2)16-12(3)13-4-6-14(7-5-13)17-9-8-15-10-17;1-12(2)15-14(11-16-9-6-10-16)13-7-4-3-5-8-13;1-10(2)14(3)8-11-9-15-7-5-4-6-12(15)13-11/h6-9,11,17H,10H2,1-5H3;3-6,12,15,17H,7-11H2,1-2H3;3-5,12,14H,6-11,13H2,1-2H3;3-7,13,15-16H,8-12H2,1-2H3;4-12,16H,1-3H3;3-5,7-8,12,14-15H,6,9-11H2,1-2H3;4-7,9-10H,8H2,1-3H3/t;;;;;14-;/m.....0./s1
InChIKeyAXGFDWKOGDZCFF-BCPMBHCISA-N
MW1702.91 g/mol
LogP17.23
Rot. Bonds32

About N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine

N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine (PubChem CID 157259125) has the molecular formula C101H153ClN18O3 and a molecular weight of 1702.91 g/mol. Its IUPAC name is N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine.

Molecular Properties

Compound NameN-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine
PubChem CID157259125
Molecular FormulaC101H153ClN18O3
Molecular Weight1702.91 g/mol
Exact Mass1701.21
IUPAC NameN-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine
SMILESCC(C)N(C)Cc1cn2ccccc2n1.CC(C)N(CCN1CCOCC1)Cc1cccnc1.CC(C)NC(C)c1ccc(-n2ccnc2)cc1.CC(C)NCC(c1ccccc1)N1CCOCC1.CC(C)NCC(c1ccccc1Cl)N1CCOCC1.CC(C)N[C@@H](CN1CCC1)c1ccccc1.Cc1ccccc1-n1nc(C)c(CNC(C)C)c1C
InChIInChI=1S/C16H23N3.C15H23ClN2O.C15H25N3O.C15H24N2O.C14H19N3.C14H22N2.C12H17N3/c1-11(2)17-10-15-13(4)18-19(14(15)5)16-9-7-6-8-12(16)3;1-12(2)17-11-15(18-7-9-19-10-8-18)13-5-3-4-6-14(13)16;1-14(2)18(13-15-4-3-5-16-12-15)7-6-17-8-10-19-11-9-17;1-13(2)16-12-15(14-6-4-3-5-7-14)17-8-10-18-11-9-17;1-11(2)16-12(3)13-4-6-14(7-5-13)17-9-8-15-10-17;1-12(2)15-14(11-16-9-6-10-16)13-7-4-3-5-8-13;1-10(2)14(3)8-11-9-15-7-5-4-6-12(15)13-11/h6-9,11,17H,10H2,1-5H3;3-6,12,15,17H,7-11H2,1-2H3;3-5,12,14H,6-11,13H2,1-2H3;3-7,13,15-16H,8-12H2,1-2H3;4-12,16H,1-3H3;3-5,7-8,12,14-15H,6,9-11H2,1-2H3;4-7,9-10H,8H2,1-3H3/t;;;;;14-;/m.....0./s1
InChIKeyAXGFDWKOGDZCFF-BCPMBHCISA-N
XLogP17.23
TPSA173.11 Ų
H-Bond Donors5
H-Bond Acceptors21
Rotatable Bonds32
Heavy Atoms123
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001702.91
LogP ≤ 517.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1021

Analyze N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine with MolForge

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Launch Full Analysis

Related Compounds

(3R)-1-[5-chloro-7-(7-fluoro-2-methylindazol-5-yl)-1,8-naphthyridin-3-yl]-4-[[4-[7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-1,8-naphthyridin-3-yl]-6-methylpiperazin-2-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
CID 168978949
(3R)-4-[4-[5-chloro-7-(7-fluoro-2-methylindazol-5-yl)-1,8-naphthyridin-3-yl]-6-methylpiperazin-2-yl]-1-[2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrido[2,3-d]pyrimidin-6-yl]-N-methylpyrrolidin-3-amine
CID 170010725
4-Chloro-6-[3-[[4-[7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-1,8-naphthyridin-3-yl]-6-methylpiperazin-2-yl]methyl]pyrrolidin-1-yl]-2-(7-fluoro-2-methylindazol-5-yl)-1,8-naphthyridine
CID 170011811
3-[1-[(2-Chlorophenyl)methyl]indol-5-yl]-1-[4-[4-(2-ethoxyethyl)piperazin-1-yl]cyclohexyl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 23729361
3-[1-[(2-Chlorophenyl)methyl]indol-5-yl]-1-[1-[1-(2-methoxyethyl)piperidin-4-yl]piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 68458178
2-[4-[4-Amino-3-[1-[(2-chlorophenyl)methyl]indol-5-yl]pyrazolo[3,4-d]pyrimidin-1-yl]-1-piperidin-4-ylpiperidin-1-ium-1-yl]ethanol
CID 69265704
N-[(6-chloro-3-pyridinyl)-[9-(1H-indazol-5-yl)-2-[4-(2-methoxyethyl)piperazin-1-yl]purin-8-yl]methyl]-9-(1H-indazol-6-yl)purin-2-amine
CID 123244934
2-N-[4-[3-[4-[1-amino-2-[[3-[3-[4-(1-aminocyclobutyl)phenyl]-5-phenylimidazo[4,5-b]pyridin-2-yl]pyrazin-2-yl]amino]cyclobutyl]phenyl]-5-phenylimidazo[4,5-b]pyridin-2-yl]-1-methylpyrazol-3-yl]-1-[4-[2-(4-amino-6-chloropyrimidin-5-yl)-5-phenylimidazo[4,5-b]pyridin-3-yl]phenyl]cyclobutane-1,2-diamine
CID 123622238
6-chloro-2-(4-morpholin-4-ylphenyl)-N-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-4-yl]-1H-imidazo[4,5-b]pyridin-7-amine
CID 134176933
6-chloro-2-[4-[4-(2-methoxyethyl)piperazin-1-yl]phenyl]-N-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-4-yl]-1H-imidazo[4,5-b]pyridin-7-amine
CID 134176941
2-[(3S)-3-[1-[1-[(1R)-1-(2,4-dichlorophenyl)-2-[(5R)-5-[1-[1-[(1R)-1-(2,4-dichlorophenyl)-2-[(5S)-5-[1-[1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-3-methylpyrazolo[3,4-b]pyrazin-6-yl]azetidin-3-yl]-1-(2-hydroxyethyl)piperidin-3-yl]ethyl]-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]azetidin-3-yl]-1-(2-hydroxyethyl)piperidin-3-yl]ethyl]-3-methylpyrazolo[3,4-d]pyrimidin-6-yl]azetidin-3-yl]piperidin-1-yl]ethanol
CID 134225293
6-(1,3-dimethylpyrazolo[4,5-b]pyridin-6-yl)-N-[4-[4-[[1-methyl-6-[6-[(4-methylcyclohexyl)amino]-2-morpholin-4-ylpyrimidin-4-yl]pyrazolo[4,3-c]pyridin-3-yl]methyl]triazol-2-yl]cyclohexyl]-2-morpholin-4-ylpyrimidin-4-amine
CID 145062167

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine?
The IUPAC name of N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine (CID 157259125) is N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine.
What is the SMILES notation for N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine?
The canonical SMILES for N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine is CC(C)N(C)Cc1cn2ccccc2n1.CC(C)N(CCN1CCOCC1)Cc1cccnc1.CC(C)NC(C)c1ccc(-n2ccnc2)cc1.CC(C)NCC(c1ccccc1)N1CCOCC1.CC(C)NCC(c1ccccc1Cl)N1CCOCC1.CC(C)N[C@@H](CN1CCC1)c1ccccc1.Cc1ccccc1-n1nc(C)c(CNC(C)C)c1C.
What is the InChIKey of N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine?
The InChIKey is AXGFDWKOGDZCFF-BCPMBHCISA-N. The full InChI is InChI=1S/C16H23N3.C15H23ClN2O.C15H25N3O.C15H24N2O.C14H19N3.C14H22N2.C12H17N3/c1-11(2)17-10-15-13(4)18-19(14(15)5)16-9-7-6-8-12(16)3;1-12(2)17-11-15(18-7-9-19-10-8-18)13-5-3-4-6-14(13)16;1-14(2)18(13-15-4-3-5-16-12-15)7-6-17-8-10-19-11-9-17;1-13(2)16-12-15(14-6-4-3-5-7-14)17-8-10-18-11-9-17;1-11(2)16-12(3)13-4-6-14(7-5-13)17-9-8-15-10-17;1-12(2)15-14(11-16-9-6-10-16)13-7-4-3-5-8-13;1-10(2)14(3)8-11-9-15-7-5-4-6-12(15)13-11/h6-9,11,17H,10H2,1-5H3;3-6,12,15,17H,7-11H2,1-2H3;3-5,12,14H,6-11,13H2,1-2H3;3-7,13,15-16H,8-12H2,1-2H3;4-12,16H,1-3H3;3-5,7-8,12,14-15H,6,9-11H2,1-2H3;4-7,9-10H,8H2,1-3H3/t;;;;;14-;/m.....0./s1.
What are the key properties of N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine?
N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine has a molecular weight of 1702.91 g/mol, XLogP of 17.23, 32 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-(azetidin-1-yl)-1-phenylethyl]propan-2-amine;N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]propan-2-amine;N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]propan-2-amine;N-(imidazo[1,2-a]pyridin-2-ylmethyl)-N-methylpropan-2-amine;N-[1-(4-imidazol-1-ylphenyl)ethyl]propan-2-amine;N-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)propan-2-amine;N-(2-morpholin-4-yl-2-phenylethyl)propan-2-amine is sourced from PubChem (CID 157259125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).