(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)

C175H282N36O4S — CID 159927564

IUPAC(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)
SMILESCC(C)c1ccc(C(C)N(C)C)cn1.CC(C)c1ccc(C2CCC2)c(CN(C)C)n1.CC(C)c1ccc(S(C)(=O)=O)c(CN(C)C)n1.CC(C)c1ccc([C@@H](C)N(C)C)cn1.CC(C)c1ccc([C@H](C)N(C)C)cn1.CC(C)c1cccc(CN(C)C)n1.CC(C)c1cccc(N2C[C@@H](N)CC2=O)n1.CCNC(=O)c1ccc(C(C)C)nc1CN(C)C.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1
InChIInChI=1S/C15H24N2.C14H23N3O.3C13H21N3.C12H17N3O.3C12H19N3.C12H20N2O2S.3C12H20N2.C11H18N2/c1-11(2)14-9-8-13(12-6-5-7-12)15(16-14)10-17(3)4;1-6-15-14(18)11-7-8-12(10(2)3)16-13(11)9-17(4)5;3*1-9(2)12-6-5-10(3)13(15-12)16(4)11-7-14-8-11;1-8(2)10-4-3-5-11(14-10)15-7-9(13)6-12(15)16;3*1-9(2)11-5-4-6-12(14-11)15-7-10(8-15)13-3;1-9(2)10-6-7-12(17(5,15)16)11(13-10)8-14(3)4;3*1-9(2)12-7-6-11(8-13-12)10(3)14(4)5;1-9(2)11-7-5-6-10(12-11)8-13(3)4/h8-9,11-12H,5-7,10H2,1-4H3;7-8,10H,6,9H2,1-5H3,(H,15,18);3*5-6,9,11,14H,7-8H2,1-4H3;3-5,8-9H,6-7,13H2,1-2H3;3*4-6,9-10,13H,7-8H2,1-3H3;6-7,9H,8H2,1-5H3;3*6-10H,1-5H3;5-7,9H,8H2,1-4H3/t;;;;;9-;;;;;2*10-;;/m.....0....10../s1
InChIKeyNZFIDORPVAATQJ-BENKAYNZSA-N
MW2986.50 g/mol
LogP29.84
Rot. Bonds45

About (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)

(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) (PubChem CID 159927564) has the molecular formula C175H282N36O4S and a molecular weight of 2986.50 g/mol. Its IUPAC name is (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine).

Molecular Properties

Compound Name(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)
PubChem CID159927564
Molecular FormulaC175H282N36O4S
Molecular Weight2986.50 g/mol
Exact Mass2984.27
IUPAC Name(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)
SMILESCC(C)c1ccc(C(C)N(C)C)cn1.CC(C)c1ccc(C2CCC2)c(CN(C)C)n1.CC(C)c1ccc(S(C)(=O)=O)c(CN(C)C)n1.CC(C)c1ccc([C@@H](C)N(C)C)cn1.CC(C)c1ccc([C@H](C)N(C)C)cn1.CC(C)c1cccc(CN(C)C)n1.CC(C)c1cccc(N2C[C@@H](N)CC2=O)n1.CCNC(=O)c1ccc(C(C)C)nc1CN(C)C.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1
InChIInChI=1S/C15H24N2.C14H23N3O.3C13H21N3.C12H17N3O.3C12H19N3.C12H20N2O2S.3C12H20N2.C11H18N2/c1-11(2)14-9-8-13(12-6-5-7-12)15(16-14)10-17(3)4;1-6-15-14(18)11-7-8-12(10(2)3)16-13(11)9-17(4)5;3*1-9(2)12-6-5-10(3)13(15-12)16(4)11-7-14-8-11;1-8(2)10-4-3-5-11(14-10)15-7-9(13)6-12(15)16;3*1-9(2)11-5-4-6-12(14-11)15-7-10(8-15)13-3;1-9(2)10-6-7-12(17(5,15)16)11(13-10)8-14(3)4;3*1-9(2)12-7-6-11(8-13-12)10(3)14(4)5;1-9(2)11-7-5-6-10(12-11)8-13(3)4/h8-9,11-12H,5-7,10H2,1-4H3;7-8,10H,6,9H2,1-5H3,(H,15,18);3*5-6,9,11,14H,7-8H2,1-4H3;3-5,8-9H,6-7,13H2,1-2H3;3*4-6,9-10,13H,7-8H2,1-3H3;6-7,9H,8H2,1-5H3;3*6-10H,1-5H3;5-7,9H,8H2,1-4H3/t;;;;;9-;;;;;2*10-;;/m.....0....10../s1
InChIKeyNZFIDORPVAATQJ-BENKAYNZSA-N
XLogP29.84
TPSA404.33 Ų
H-Bond Donors8
H-Bond Acceptors38
Rotatable Bonds45
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002986.50
LogP ≤ 529.84
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1038

Analyze (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) with MolForge

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Launch Full Analysis

Related Compounds

8-[4-(1-acetylpiperidin-4-yl)anilino]-6-(3,3-difluoropyrrolidin-1-yl)-2H-2,7-naphthyridin-1-one;N,2-dimethyl-2-[4-[[3-(5-methylsulfonyl-3-pyridinyl)-8-oxo-7H-2,7-naphthyridin-1-yl]amino]phenyl]propanamide
CID 87191497
N-[8-[4-(1-acetylpiperidin-4-yl)anilino]-6-(3,3-difluoropyrrolidin-1-yl)-2-methyl-1-oxo-2,7-naphthyridin-3-yl]-2-methyl-2-[4-[[3-(5-methylsulfonyl-3-pyridinyl)-8-oxo-7H-2,7-naphthyridin-1-yl]amino]phenyl]propanamide
CID 140192859
(14S,17R)-17-(4-tert-butyl-2-pyridinyl)-8-(6-fluoro-2-pyridinyl)-12,12-dimethyl-2,2-dioxo-2lambda6-thia-3,9,11,18,23-pentazatetracyclo[17.3.1.111,14.05,10]tetracosa-1(22),5(10),6,8,19(23),20-hexaen-4-one
CID 156089151
5-(2-acetamido-4-pyridinyl)-2-amino-N-(cyclopropylmethyl)pyridine-3-carboxamide;N-[4-[6-amino-5-(1-bicyclo[1.1.1]pentanylmethylsulfonyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[6-amino-5-(pyrrolidine-1-carbonyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[5-[2-[2-(2,2-difluorocyclopropyl)-2-oxoethyl]-4-pyridinyl]-2-methyl-3-pyridinyl]-2,4-difluorobenzenesulfonamide;2,4-difluoro-N-[5-[2-(2-oxopropyl)-4-pyridinyl]-3-pyridinyl]benzenesulfonamide;N-[4-(5-phenacyl-3-pyridinyl)-2-pyridinyl]acetamide
CID 157690456
N-[[6-[2-(1,1-difluoroethyl)-4-pyridinyl]-5-methyl-3-pyridinyl]methyl]-5-(3-methyl-2-pyridinyl)pyridine-2-carboxamide;N-[[6-[2-(1,1-difluoroethyl)-4-pyridinyl]-3-pyridinyl]methyl]-5-(3-methyl-2-pyridinyl)pyridine-2-carboxamide;1-[5-[6-[3-[6-[2-(1,1-difluoroethyl)-4-pyridinyl]-3-pyridinyl]propanoyl]-3-pyridinyl]-2-pyridinyl]pyrrolidin-2-one;N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-5-(3-methyl-2-pyridinyl)pyridine-2-carboxamide;N-[[6-(1-methylidene-1-oxo-1,4-thiazinan-4-yl)-3-pyridinyl]methyl]-6-pyrazin-2-ylpyridine-3-carboxamide
CID 158915067
N-[4-(6-amino-5-benzylsulfonyl-3-pyridinyl)-2-pyridinyl]acetamide;N-[4-[6-amino-5-(piperidine-1-carbonyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[6-amino-5-(propan-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-(cyclopropanecarbonyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(4,4-difluoropiperidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one
CID 162193320
(14S,17R)-8-(4,4-difluorocyclohexen-1-yl)-12,12-dimethyl-2,2-dioxo-17-pyridin-2-yl-2lambda6-thia-3,9,11,18,23-pentazatetracyclo[17.3.1.111,14.05,10]tetracosa-1(22),5(10),6,8,19(23),20-hexaen-4-one;(14S,17R)-8-(4,4-difluorocyclohexyl)-12,12-dimethyl-2,2-dioxo-17-pyridin-2-yl-2lambda6-thia-3,9,11,18,23-pentazatetracyclo[17.3.1.111,14.05,10]tetracosa-1(22),5(10),6,8,19(23),20-hexaen-4-one
CID 167538158
N-[[2-(6-cyclopropyl-3,4-dihydro-2H-1,8-naphthyridin-1-yl)-1,6-naphthyridin-7-yl]methyl]-6-(difluoromethyl)-5-methylsulfonylpyridine-3-carboxamide
CID 170544667
N-[[2-(7-cyclopropyl-3,4-dihydro-2H-1,8-naphthyridin-1-yl)-1,6-naphthyridin-7-yl]methyl]-6-(difluoromethyl)-5-methylsulfonylpyridine-3-carboxamide
CID 170544772
N-[[2-[2-(4-acetamido-3,3-difluoropiperidin-1-yl)pyrimidin-4-yl]-1,6-naphthyridin-7-yl]methyl]-6-methyl-5-methylsulfonylpyridine-3-carboxamide
CID 176203741
N-[[2-[4-fluoro-6-[(6R)-6-methyl-4,7-diazaspiro[2.5]octan-7-yl]-2-pyridinyl]-1,6-naphthyridin-7-yl]methyl]-6-methyl-5-methylsulfonylpyridine-3-carboxamide
CID 176203789
N-[[2-[6-[(3aS,7aS)-5-(2,2-difluoroethyl)-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridin-2-yl]-2-pyridinyl]-1,6-naphthyridin-7-yl]methyl]-5-methylsulfonylpyridine-3-carboxamide
CID 176203800

Frequently Asked Questions

What is the IUPAC name of (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)?
The IUPAC name of (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) (CID 159927564) is (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine).
What is the SMILES notation for (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)?
The canonical SMILES for (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) is CC(C)c1ccc(C(C)N(C)C)cn1.CC(C)c1ccc(C2CCC2)c(CN(C)C)n1.CC(C)c1ccc(S(C)(=O)=O)c(CN(C)C)n1.CC(C)c1ccc([C@@H](C)N(C)C)cn1.CC(C)c1ccc([C@H](C)N(C)C)cn1.CC(C)c1cccc(CN(C)C)n1.CC(C)c1cccc(N2C[C@@H](N)CC2=O)n1.CCNC(=O)c1ccc(C(C)C)nc1CN(C)C.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.CNC1CN(c2cccc(C(C)C)n2)C1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.Cc1ccc(C(C)C)nc1N(C)C1CNC1.
What is the InChIKey of (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)?
The InChIKey is NZFIDORPVAATQJ-BENKAYNZSA-N. The full InChI is InChI=1S/C15H24N2.C14H23N3O.3C13H21N3.C12H17N3O.3C12H19N3.C12H20N2O2S.3C12H20N2.C11H18N2/c1-11(2)14-9-8-13(12-6-5-7-12)15(16-14)10-17(3)4;1-6-15-14(18)11-7-8-12(10(2)3)16-13(11)9-17(4)5;3*1-9(2)12-6-5-10(3)13(15-12)16(4)11-7-14-8-11;1-8(2)10-4-3-5-11(14-10)15-7-9(13)6-12(15)16;3*1-9(2)11-5-4-6-12(14-11)15-7-10(8-15)13-3;1-9(2)10-6-7-12(17(5,15)16)11(13-10)8-14(3)4;3*1-9(2)12-7-6-11(8-13-12)10(3)14(4)5;1-9(2)11-7-5-6-10(12-11)8-13(3)4/h8-9,11-12H,5-7,10H2,1-4H3;7-8,10H,6,9H2,1-5H3,(H,15,18);3*5-6,9,11,14H,7-8H2,1-4H3;3-5,8-9H,6-7,13H2,1-2H3;3*4-6,9-10,13H,7-8H2,1-3H3;6-7,9H,8H2,1-5H3;3*6-10H,1-5H3;5-7,9H,8H2,1-4H3/t;;;;;9-;;;;;2*10-;;/m.....0....10../s1.
What are the key properties of (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine)?
(4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) has a molecular weight of 2986.50 g/mol, XLogP of 29.84, 45 rotatable bonds, 8 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-amino-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-2-one;tris(N-(azetidin-3-yl)-N,3-dimethyl-6-propan-2-ylpyridin-2-amine);1-(3-cyclobutyl-6-propan-2-yl-2-pyridinyl)-N,N-dimethylmethanamine;2-[(dimethylamino)methyl]-N-ethyl-6-propan-2-ylpyridine-3-carboxamide;N,N-dimethyl-1-(3-methylsulfonyl-6-propan-2-yl-2-pyridinyl)methanamine;(1R)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;(1S)-N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-3-pyridinyl)ethanamine;N,N-dimethyl-1-(6-propan-2-yl-2-pyridinyl)methanamine;tris(N-methyl-1-(6-propan-2-yl-2-pyridinyl)azetidin-3-amine) is sourced from PubChem (CID 159927564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).