2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile

C252H220F12N34O21S3 — CID 159374095

IUPAC2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile
SMILESCCC(=O)Nc1cccc(C#Cc2c(C#N)c3ccc(OC)cc3n2CC)c1.CCn1c(C#Cc2ccc(N(C)C)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2cccc(NC(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NC(C)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)CC)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(C)(=O)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(OC)c2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(NC(=O)c2ccccc2)c(C#N)c2ccc(OC)cc21.CCn1c(NC(C)=O)c(C#N)c2ccc(OC)cc21
InChIInChI=1S/C24H23N3O2.C23H23N3O3S.C23H21N3O2.C22H18F3N3.C22H21N3O3S.C22H19N3O2.2C21H15F3N2O.C21H19N3O3S.C20H14F3N3.C19H17N3O2.C14H15N3O2/c1-5-27-22(21(15-25)20-11-10-19(29-4)14-23(20)27)12-9-17-7-6-8-18(13-17)26-24(28)16(2)3;1-5-26-22(21(15-24)20-11-10-19(29-4)14-23(20)26)12-9-17-7-6-8-18(13-17)25-30(27,28)16(2)3;1-4-23(27)25-17-8-6-7-16(13-17)9-12-21-20(15-24)19-11-10-18(28-3)14-22(19)26(21)5-2;1-4-28-20(12-7-15-5-9-17(10-6-15)27(2)3)19(14-26)18-11-8-16(13-21(18)28)22(23,24)25;1-4-25-21(20(15-23)19-11-10-18(28-3)14-22(19)25)12-9-16-7-6-8-17(13-16)24-29(26,27)5-2;1-4-25-21(11-8-16-6-5-7-17(12-16)24-15(2)26)20(14-23)19-10-9-18(27-3)13-22(19)25;1-3-26-19(11-6-14-4-8-16(27-2)9-5-14)18(13-25)17-10-7-15(12-20(17)26)21(22,23)24;1-3-26-19(10-7-14-5-4-6-16(11-14)27-2)18(13-25)17-9-8-15(12-20(17)26)21(22,23)24;1-4-24-20(19(14-22)18-10-9-17(27-2)13-21(18)24)11-8-15-6-5-7-16(12-15)23-28(3,25)26;1-2-26-18(10-5-13-3-7-15(25)8-4-13)17(12-24)16-9-6-14(11-19(16)26)20(21,22)23;1-3-22-17-11-14(24-2)9-10-15(17)16(12-20)18(22)21-19(23)13-7-5-4-6-8-13;1-4-17-13-7-10(19-3)5-6-11(13)12(8-15)14(17)16-9(2)18/h6-8,10-11,13-14,16H,5H2,1-4H3,(H,26,28);6-8,10-11,13-14,16,25H,5H2,1-4H3;6-8,10-11,13-14H,4-5H2,1-3H3,(H,25,27);5-6,8-11,13H,4H2,1-3H3;6-8,10-11,13-14,24H,4-5H2,1-3H3;5-7,9-10,12-13H,4H2,1-3H3,(H,24,26);4-5,7-10,12H,3H2,1-2H3;4-6,8-9,11-12H,3H2,1-2H3;5-7,9-10,12-13,23H,4H2,1-3H3;3-4,6-9,11H,2,25H2,1H3;4-11H,3H2,1-2H3,(H,21,23);5-7H,4H2,1-3H3,(H,16,18)
InChIKeyLKCCECLNDIPRCE-UHFFFAOYSA-N
MW4384.93 g/mol
LogP49.60
Rot. Bonds39

About 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile

2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile (PubChem CID 159374095) has the molecular formula C252H220F12N34O21S3 and a molecular weight of 4384.93 g/mol. Its IUPAC name is 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile.

Molecular Properties

Compound Name2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile
PubChem CID159374095
Molecular FormulaC252H220F12N34O21S3
Molecular Weight4384.93 g/mol
Exact Mass4381.62
IUPAC Name2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile
SMILESCCC(=O)Nc1cccc(C#Cc2c(C#N)c3ccc(OC)cc3n2CC)c1.CCn1c(C#Cc2ccc(N(C)C)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2cccc(NC(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NC(C)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)CC)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(C)(=O)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(OC)c2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(NC(=O)c2ccccc2)c(C#N)c2ccc(OC)cc21.CCn1c(NC(C)=O)c(C#N)c2ccc(OC)cc21
InChIInChI=1S/C24H23N3O2.C23H23N3O3S.C23H21N3O2.C22H18F3N3.C22H21N3O3S.C22H19N3O2.2C21H15F3N2O.C21H19N3O3S.C20H14F3N3.C19H17N3O2.C14H15N3O2/c1-5-27-22(21(15-25)20-11-10-19(29-4)14-23(20)27)12-9-17-7-6-8-18(13-17)26-24(28)16(2)3;1-5-26-22(21(15-24)20-11-10-19(29-4)14-23(20)26)12-9-17-7-6-8-18(13-17)25-30(27,28)16(2)3;1-4-23(27)25-17-8-6-7-16(13-17)9-12-21-20(15-24)19-11-10-18(28-3)14-22(19)26(21)5-2;1-4-28-20(12-7-15-5-9-17(10-6-15)27(2)3)19(14-26)18-11-8-16(13-21(18)28)22(23,24)25;1-4-25-21(20(15-23)19-11-10-18(28-3)14-22(19)25)12-9-16-7-6-8-17(13-16)24-29(26,27)5-2;1-4-25-21(11-8-16-6-5-7-17(12-16)24-15(2)26)20(14-23)19-10-9-18(27-3)13-22(19)25;1-3-26-19(11-6-14-4-8-16(27-2)9-5-14)18(13-25)17-10-7-15(12-20(17)26)21(22,23)24;1-3-26-19(10-7-14-5-4-6-16(11-14)27-2)18(13-25)17-9-8-15(12-20(17)26)21(22,23)24;1-4-24-20(19(14-22)18-10-9-17(27-2)13-21(18)24)11-8-15-6-5-7-16(12-15)23-28(3,25)26;1-2-26-18(10-5-13-3-7-15(25)8-4-13)17(12-24)16-9-6-14(11-19(16)26)20(21,22)23;1-3-22-17-11-14(24-2)9-10-15(17)16(12-20)18(22)21-19(23)13-7-5-4-6-8-13;1-4-17-13-7-10(19-3)5-6-11(13)12(8-15)14(17)16-9(2)18/h6-8,10-11,13-14,16H,5H2,1-4H3,(H,26,28);6-8,10-11,13-14,16,25H,5H2,1-4H3;6-8,10-11,13-14H,4-5H2,1-3H3,(H,25,27);5-6,8-11,13H,4H2,1-3H3;6-8,10-11,13-14,24H,4-5H2,1-3H3;5-7,9-10,12-13H,4H2,1-3H3,(H,24,26);4-5,7-10,12H,3H2,1-2H3;4-6,8-9,11-12H,3H2,1-2H3;5-7,9-10,12-13,23H,4H2,1-3H3;3-4,6-9,11H,2,25H2,1H3;4-11H,3H2,1-2H3,(H,21,23);5-7H,4H2,1-3H3,(H,16,18)
InChIKeyLKCCECLNDIPRCE-UHFFFAOYSA-N
XLogP49.60
TPSA750.21 Ų
H-Bond Donors9
H-Bond Acceptors47
Rotatable Bonds39
Heavy Atoms322
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004384.93
LogP ≤ 549.60
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1047

Analyze 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile with MolForge

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Related Compounds

N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]methanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]acetamide
CID 157180715
N-[4-[3-cyano-6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]methanesulfonamide;N-[4-[6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[6-(difluoromethoxy)-1-propan-2-ylindol-2-yl]phenyl]ethanesulfonamide;1-ethyl-2-(methylamino)-6-(trifluoromethyl)indole-3-carbonitrile
CID 157247576
N-[4-[3-cyano-6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]methanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]methanesulfonamide;1-[3-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 157685862
N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-methylpropanamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-2-phenylacetamide;N-[4-(3-cyano-6-ethoxy-1-ethylindol-2-yl)phenyl]-3-phenylpropanamide;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-ethyl-6-(trifluoromethoxy)indole-3-carbonitrile;2-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-methyl-6-(trifluoromethoxy)indole-3-carbonitrile
CID 158149040
butyl N-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]carbamate;tert-butyl 4-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]piperazine-1-carboxylate;tert-butyl N-[1-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]piperidin-4-yl]carbamate;N-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]propane-2-sulfonamide;methyl N-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]carbamate
CID 158198035
2-(4-aminophenyl)-1-ethyl-5-phenylmethoxyindole-3-carbonitrile;2-(4-aminophenyl)-6-phenylmethoxy-1-propylindole-3-carbonitrile;N-[4-[3-cyano-1-ethyl-6-(trifluoromethoxy)indol-2-yl]phenyl]-3-phenylpropanamide;N-[3-(3-cyano-5-phenylmethoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;N-[3-(3-cyano-5-phenylmethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]methanesulfonamide;N-[4-(3-cyano-6-phenylmethoxy-1-propylindol-2-yl)phenyl]propane-1-sulfonamide
CID 158418916
N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)-N-propan-2-ylbenzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide;(4-methoxyphenyl) N-[3-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate
CID 158445629
CID 158451520
CID 158451520
N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]acetamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]cyclobutanecarboxamide;N-[4-(3-cyano-1-ethylindol-2-yl)phenyl]-2-methoxyacetamide;4-(3-cyano-1-ethyl-5-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-[2-(methylamino)ethyl]benzamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]ethenesulfonamide;N-[3-[3-cyano-1-ethyl-6-(trifluoromethyl)indol-2-yl]phenyl]propane-1-sulfonamide
CID 158544536
2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[4-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-N-methylmethanesulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-hydroxy-2-(2-phenylethynyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-hydroxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-6-hydroxy-2-[2-[4-(trifluoromethyl)phenyl]ethynyl]indole-3-carbonitrile
CID 158663946
N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile
CID 158692053
1-[3-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea;N-[4-[6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]ethanesulfonamide;N-[4-[6-(difluoromethoxy)-1-methylindol-2-yl]phenyl]ethanesulfonamide;ethyl N-[[3-(3-cyano-1-ethyl-5-methoxyindol-2-yl)phenyl]carbamoyl]carbamate;1-ethyl-2-(methylamino)-6-(trifluoromethyl)indole-3-carbonitrile
CID 158881056

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile?
The IUPAC name of 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile (CID 159374095) is 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile.
What is the SMILES notation for 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile?
The canonical SMILES for 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile is CCC(=O)Nc1cccc(C#Cc2c(C#N)c3ccc(OC)cc3n2CC)c1.CCn1c(C#Cc2ccc(N(C)C)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(N)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2ccc(OC)cc2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(C#Cc2cccc(NC(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NC(C)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)C(C)C)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(=O)(=O)CC)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(NS(C)(=O)=O)c2)c(C#N)c2ccc(OC)cc21.CCn1c(C#Cc2cccc(OC)c2)c(C#N)c2ccc(C(F)(F)F)cc21.CCn1c(NC(=O)c2ccccc2)c(C#N)c2ccc(OC)cc21.CCn1c(NC(C)=O)c(C#N)c2ccc(OC)cc21.
What is the InChIKey of 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile?
The InChIKey is LKCCECLNDIPRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2.C23H23N3O3S.C23H21N3O2.C22H18F3N3.C22H21N3O3S.C22H19N3O2.2C21H15F3N2O.C21H19N3O3S.C20H14F3N3.C19H17N3O2.C14H15N3O2/c1-5-27-22(21(15-25)20-11-10-19(29-4)14-23(20)27)12-9-17-7-6-8-18(13-17)26-24(28)16(2)3;1-5-26-22(21(15-24)20-11-10-19(29-4)14-23(20)26)12-9-17-7-6-8-18(13-17)25-30(27,28)16(2)3;1-4-23(27)25-17-8-6-7-16(13-17)9-12-21-20(15-24)19-11-10-18(28-3)14-22(19)26(21)5-2;1-4-28-20(12-7-15-5-9-17(10-6-15)27(2)3)19(14-26)18-11-8-16(13-21(18)28)22(23,24)25;1-4-25-21(20(15-23)19-11-10-18(28-3)14-22(19)25)12-9-16-7-6-8-17(13-16)24-29(26,27)5-2;1-4-25-21(11-8-16-6-5-7-17(12-16)24-15(2)26)20(14-23)19-10-9-18(27-3)13-22(19)25;1-3-26-19(11-6-14-4-8-16(27-2)9-5-14)18(13-25)17-10-7-15(12-20(17)26)21(22,23)24;1-3-26-19(10-7-14-5-4-6-16(11-14)27-2)18(13-25)17-9-8-15(12-20(17)26)21(22,23)24;1-4-24-20(19(14-22)18-10-9-17(27-2)13-21(18)24)11-8-15-6-5-7-16(12-15)23-28(3,25)26;1-2-26-18(10-5-13-3-7-15(25)8-4-13)17(12-24)16-9-6-14(11-19(16)26)20(21,22)23;1-3-22-17-11-14(24-2)9-10-15(17)16(12-20)18(22)21-19(23)13-7-5-4-6-8-13;1-4-17-13-7-10(19-3)5-6-11(13)12(8-15)14(17)16-9(2)18/h6-8,10-11,13-14,16H,5H2,1-4H3,(H,26,28);6-8,10-11,13-14,16,25H,5H2,1-4H3;6-8,10-11,13-14H,4-5H2,1-3H3,(H,25,27);5-6,8-11,13H,4H2,1-3H3;6-8,10-11,13-14,24H,4-5H2,1-3H3;5-7,9-10,12-13H,4H2,1-3H3,(H,24,26);4-5,7-10,12H,3H2,1-2H3;4-6,8-9,11-12H,3H2,1-2H3;5-7,9-10,12-13,23H,4H2,1-3H3;3-4,6-9,11H,2,25H2,1H3;4-11H,3H2,1-2H3,(H,21,23);5-7H,4H2,1-3H3,(H,16,18).
What are the key properties of 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile?
2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile has a molecular weight of 4384.93 g/mol, XLogP of 49.60, 39 rotatable bonds, 9 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)acetamide;N-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]acetamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]ethanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]methanesulfonamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]-2-methylpropanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propanamide;N-[3-[2-(3-cyano-1-ethyl-6-methoxyindol-2-yl)ethynyl]phenyl]propane-2-sulfonamide;2-[2-[4-(dimethylamino)phenyl]ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(3-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile is sourced from PubChem (CID 159374095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).