2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile

C231H210BrClF12N28O22S3 — CID 158506269

IUPAC2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
SMILESCCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(NS(=O)(=O)CCCCl)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(OCCBr)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCO)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCOC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(SC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2cccc(N)c2)c(C#N)c2ccc(C(F)(F)F)cc21.COc1ccc2c(C#N)c(-c3ccc4c(c3)OCO4)n(C)c2c1
InChIInChI=1S/C21H22ClN3O3S.C21H23N3O3S.C21H22N2O3.C20H19BrN2O2.C20H20N2O3.C19H15F3N2O.C19H18N2OS.2C18H14F3N3.C18H13F3N2O.C18H14N2O3.C18H16N2O2/c1-3-25-20-13-17(28-2)9-10-18(20)19(14-23)21(25)15-5-7-16(8-6-15)24-29(26,27)12-4-11-22;1-4-12-28(25,26)23-16-8-6-15(7-9-16)21-19(14-22)18-11-10-17(27-3)13-20(18)24(21)5-2;1-4-23-20-13-17(25-3)9-10-18(20)19(14-22)21(23)15-5-7-16(8-6-15)26-12-11-24-2;1-3-23-19-12-16(24-2)8-9-17(19)18(13-22)20(23)14-4-6-15(7-5-14)25-11-10-21;1-3-22-19-12-16(24-2)8-9-17(19)18(13-21)20(22)14-4-6-15(7-5-14)25-11-10-23;1-3-24-17-10-13(19(20,21)22)6-9-15(17)16(11-23)18(24)12-4-7-14(25-2)8-5-12;1-4-21-18-11-14(22-2)7-10-16(18)17(12-20)19(21)13-5-8-15(23-3)9-6-13;1-2-24-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(24)11-3-6-13(23)7-4-11;1-2-24-16-9-12(18(19,20)21)6-7-14(16)15(10-22)17(24)11-4-3-5-13(23)8-11;1-2-23-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(23)11-3-6-13(24)7-4-11;1-20-15-8-12(21-2)4-5-13(15)14(9-19)18(20)11-3-6-16-17(7-11)23-10-22-16;1-3-20-17-10-14(22-2)8-9-15(17)16(11-19)18(20)12-4-6-13(21)7-5-12/h5-10,13,24H,3-4,11-12H2,1-2H3;6-11,13,23H,4-5,12H2,1-3H3;5-10,13H,4,11-12H2,1-3H3;4-9,12H,3,10-11H2,1-2H3;4-9,12,23H,3,10-11H2,1-2H3;4-10H,3H2,1-2H3;5-11H,4H2,1-3H3;2*3-9H,2,23H2,1H3;3-9,24H,2H2,1H3;3-8H,10H2,1-2H3;4-10,21H,3H2,1-2H3
InChIKeyHKMQKVBHMQRDHP-UHFFFAOYSA-N
MW4169.93 g/mol
LogP53.79
Rot. Bonds52

About 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile

2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile (PubChem CID 158506269) has the molecular formula C231H210BrClF12N28O22S3 and a molecular weight of 4169.93 g/mol. Its IUPAC name is 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile.

Molecular Properties

Compound Name2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
PubChem CID158506269
Molecular FormulaC231H210BrClF12N28O22S3
Molecular Weight4169.93 g/mol
Exact Mass4165.40
IUPAC Name2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
SMILESCCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(NS(=O)(=O)CCCCl)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(OCCBr)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCO)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCOC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(SC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2cccc(N)c2)c(C#N)c2ccc(C(F)(F)F)cc21.COc1ccc2c(C#N)c(-c3ccc4c(c3)OCO4)n(C)c2c1
InChIInChI=1S/C21H22ClN3O3S.C21H23N3O3S.C21H22N2O3.C20H19BrN2O2.C20H20N2O3.C19H15F3N2O.C19H18N2OS.2C18H14F3N3.C18H13F3N2O.C18H14N2O3.C18H16N2O2/c1-3-25-20-13-17(28-2)9-10-18(20)19(14-23)21(25)15-5-7-16(8-6-15)24-29(26,27)12-4-11-22;1-4-12-28(25,26)23-16-8-6-15(7-9-16)21-19(14-22)18-11-10-17(27-3)13-20(18)24(21)5-2;1-4-23-20-13-17(25-3)9-10-18(20)19(14-22)21(23)15-5-7-16(8-6-15)26-12-11-24-2;1-3-23-19-12-16(24-2)8-9-17(19)18(13-22)20(23)14-4-6-15(7-5-14)25-11-10-21;1-3-22-19-12-16(24-2)8-9-17(19)18(13-21)20(22)14-4-6-15(7-5-14)25-11-10-23;1-3-24-17-10-13(19(20,21)22)6-9-15(17)16(11-23)18(24)12-4-7-14(25-2)8-5-12;1-4-21-18-11-14(22-2)7-10-16(18)17(12-20)19(21)13-5-8-15(23-3)9-6-13;1-2-24-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(24)11-3-6-13(23)7-4-11;1-2-24-16-9-12(18(19,20)21)6-7-14(16)15(10-22)17(24)11-4-3-5-13(23)8-11;1-2-23-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(23)11-3-6-13(24)7-4-11;1-20-15-8-12(21-2)4-5-13(15)14(9-19)18(20)11-3-6-16-17(7-11)23-10-22-16;1-3-20-17-10-14(22-2)8-9-15(17)16(11-19)18(20)12-4-6-13(21)7-5-12/h5-10,13,24H,3-4,11-12H2,1-2H3;6-11,13,23H,4-5,12H2,1-3H3;5-10,13H,4,11-12H2,1-3H3;4-9,12H,3,10-11H2,1-2H3;4-9,12,23H,3,10-11H2,1-2H3;4-10H,3H2,1-2H3;5-11H,4H2,1-3H3;2*3-9H,2,23H2,1H3;3-9,24H,2H2,1H3;3-8H,10H2,1-2H3;4-10,21H,3H2,1-2H3
InChIKeyHKMQKVBHMQRDHP-UHFFFAOYSA-N
XLogP53.79
TPSA688.16 Ų
H-Bond Donors7
H-Bond Acceptors49
Rotatable Bonds52
Heavy Atoms298
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004169.93
LogP ≤ 553.79
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1049

Analyze 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile with MolForge

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Related Compounds

2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-[4-[2-(dimethylamino)ethoxy]phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-[4-(dimethylamino)phenyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[4-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethoxy]phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-morpholin-4-ylethoxy)phenyl]indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 157388783
2-(3-Aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-[4-(dimethylamino)phenyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-morpholin-4-ylethoxy)phenyl]indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 157574609
2-[4-[2-(aminodiazenyl)ethoxy]phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-[4-(2-aminoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-[2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenoxy]ethyl]methanesulfonamide;2-[4-[2-(dimethylamino)ethoxy]phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;2-[4-(dimethylamino)phenyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[4-[2-[(3S)-3-hydroxypyrrolidin-1-yl]ethoxy]phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfonylphenyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-morpholin-4-ylethoxy)phenyl]indole-3-carbonitrile
CID 158695692
2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 158849482
N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-chloropropane-1-sulfonamide;N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]cyclopropanesulfonamide;N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(1-butyl-3-cyano-6-methoxyindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]methanesulfonamide;N-[4-(3-cyano-5-phenylmethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide
CID 159184713
3-chloro-N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(2-hydroxyethyl)benzenesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-2-sulfonamide
CID 159261285
2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 159947054
2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonohydrazide;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 160062934
2-(3-Aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(dimethylamino)phenyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 160261679
2-(3-Aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-[4-(dimethylamino)phenyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-morpholin-4-ylethoxy)phenyl]indole-3-carbonitrile
CID 160396074
2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile
CID 160519938
3-chloro-N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(2-hydroxyethyl)benzenesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]methanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-2-sulfonamide
CID 161845424

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile?
The IUPAC name of 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile (CID 158506269) is 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile.
What is the SMILES notation for 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile?
The canonical SMILES for 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile is CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC)cc3n2CC)cc1.CCn1c(-c2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(NS(=O)(=O)CCCCl)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(-c2ccc(OCCBr)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCO)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(OCCOC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(SC)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2cccc(N)c2)c(C#N)c2ccc(C(F)(F)F)cc21.COc1ccc2c(C#N)c(-c3ccc4c(c3)OCO4)n(C)c2c1.
What is the InChIKey of 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile?
The InChIKey is HKMQKVBHMQRDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22ClN3O3S.C21H23N3O3S.C21H22N2O3.C20H19BrN2O2.C20H20N2O3.C19H15F3N2O.C19H18N2OS.2C18H14F3N3.C18H13F3N2O.C18H14N2O3.C18H16N2O2/c1-3-25-20-13-17(28-2)9-10-18(20)19(14-23)21(25)15-5-7-16(8-6-15)24-29(26,27)12-4-11-22;1-4-12-28(25,26)23-16-8-6-15(7-9-16)21-19(14-22)18-11-10-17(27-3)13-20(18)24(21)5-2;1-4-23-20-13-17(25-3)9-10-18(20)19(14-22)21(23)15-5-7-16(8-6-15)26-12-11-24-2;1-3-23-19-12-16(24-2)8-9-17(19)18(13-22)20(23)14-4-6-15(7-5-14)25-11-10-21;1-3-22-19-12-16(24-2)8-9-17(19)18(13-21)20(22)14-4-6-15(7-5-14)25-11-10-23;1-3-24-17-10-13(19(20,21)22)6-9-15(17)16(11-23)18(24)12-4-7-14(25-2)8-5-12;1-4-21-18-11-14(22-2)7-10-16(18)17(12-20)19(21)13-5-8-15(23-3)9-6-13;1-2-24-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(24)11-3-6-13(23)7-4-11;1-2-24-16-9-12(18(19,20)21)6-7-14(16)15(10-22)17(24)11-4-3-5-13(23)8-11;1-2-23-16-9-12(18(19,20)21)5-8-14(16)15(10-22)17(23)11-3-6-13(24)7-4-11;1-20-15-8-12(21-2)4-5-13(15)14(9-19)18(20)11-3-6-16-17(7-11)23-10-22-16;1-3-20-17-10-14(22-2)8-9-15(17)16(11-19)18(20)12-4-6-13(21)7-5-12/h5-10,13,24H,3-4,11-12H2,1-2H3;6-11,13,23H,4-5,12H2,1-3H3;5-10,13H,4,11-12H2,1-3H3;4-9,12H,3,10-11H2,1-2H3;4-9,12,23H,3,10-11H2,1-2H3;4-10H,3H2,1-2H3;5-11H,4H2,1-3H3;2*3-9H,2,23H2,1H3;3-9,24H,2H2,1H3;3-8H,10H2,1-2H3;4-10,21H,3H2,1-2H3.
What are the key properties of 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile?
2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile has a molecular weight of 4169.93 g/mol, XLogP of 53.79, 52 rotatable bonds, 7 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(4-aminophenyl)-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-(1,3-benzodioxol-5-yl)-6-methoxy-1-methylindole-3-carbonitrile;2-[4-(2-bromoethoxy)phenyl]-1-ethyl-6-methoxyindole-3-carbonitrile;3-chloro-N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;1-ethyl-2-[4-(2-hydroxyethoxy)phenyl]-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-methoxyindole-3-carbonitrile;1-ethyl-2-(4-hydroxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-methoxy-2-[4-(2-methoxyethoxy)phenyl]indole-3-carbonitrile;1-ethyl-6-methoxy-2-(4-methylsulfanylphenyl)indole-3-carbonitrile;1-ethyl-2-(4-methoxyphenyl)-6-(trifluoromethyl)indole-3-carbonitrile is sourced from PubChem (CID 158506269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).