tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate

C300H313ClF12N40O31S8 — CID 160617076

IUPACtert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(C4CC4)cc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(OCC(F)F)ccc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-n4ccnc4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2CC)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)c(Cl)c1.CCn1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(C(C)C)cc21.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2ccc(OCC(F)F)cc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(CC2CC2)c2cc(OCC(F)F)ccc12
InChIInChI=1S/C27H29N3O2.C26H24ClN5O3S.C26H25N5O2.C26H29N3O2.2C25H27F2N3O3S.C25H25F2N3O3.C25H29N3O2S.2C24H23F2N3O3S.C24H25F2N3O3S.C23H27N3O2S/c1-27(2,3)32-26(31)29-20-12-9-18(10-13-20)25-23(16-28)22-14-11-19(17-7-8-17)15-24(22)30(25)21-5-4-6-21;1-2-13-36(33,34)31-17-7-9-21(23(27)14-17)25-22(16-28)20-10-8-19(35-26-29-11-4-12-30-26)15-24(20)32(25)18-5-3-6-18;1-17(2)33-26(32)29-19-8-6-18(7-9-19)25-23(15-27)22-11-10-21(30-13-12-28-16-30)14-24(22)31(25)20-4-3-5-20;1-5-29-24-14-20(16(2)3)10-13-22(24)23(15-27)25(29)19-8-11-21(12-9-19)28-26(30)31-17(4)18-6-7-18;1-16(2)15-34(31,32)29-19-7-5-18(6-8-19)25-22(12-28)21-10-9-20(33-14-24(26)27)11-23(21)30(25)13-17-3-4-17;1-16(2)15-34(31,32)29-18-8-6-17(7-9-18)25-22(13-28)21-12-20(33-14-24(26)27)10-11-23(21)30(25)19-4-3-5-19;1-15(2)33-25(31)29-18-7-5-17(6-8-18)24-21(12-28)20-10-9-19(32-14-23(26)27)11-22(20)30(24)13-16-3-4-16;1-4-14-31(29,30)27-20-11-8-18(9-12-20)25-23(16-26)22-13-10-19(17(2)3)15-24(22)28(25)21-6-5-7-21;25-23(26)14-32-18-7-10-20-21(12-27)24(29(22(20)11-18)13-15-1-2-15)16-3-5-17(6-4-16)28-33(30,31)19-8-9-19;25-23(26)14-32-18-8-11-22-20(12-18)21(13-27)24(29(22)17-2-1-3-17)15-4-6-16(7-5-15)28-33(30,31)19-9-10-19;1-2-11-33(30,31)28-18-7-5-17(6-8-18)24-21(13-27)20-10-9-19(32-15-23(25)26)12-22(20)29(24)14-16-3-4-16;1-5-13-29(27,28)25-19-10-7-17(8-11-19)23-21(15-24)20-12-9-18(16(3)4)14-22(20)26(23)6-2/h9-15,17,21H,4-8H2,1-3H3,(H,29,31);4,7-12,14-15,18,31H,2-3,5-6,13H2,1H3;6-14,16-17,20H,3-5H2,1-2H3,(H,29,32);8-14,16-18H,5-7H2,1-4H3,(H,28,30);5-11,16-17,24,29H,3-4,13-15H2,1-2H3;6-12,16,19,24,29H,3-5,14-15H2,1-2H3;5-11,15-16,23H,3-4,13-14H2,1-2H3,(H,29,31);8-13,15,17,21,27H,4-7,14H2,1-3H3;3-7,10-11,15,19,23,28H,1-2,8-9,13-14H2;4-8,11-12,17,19,23,28H,1-3,9-10,14H2;5-10,12,16,23,28H,2-4,11,14-15H2,1H3;7-12,14,16,25H,5-6,13H2,1-4H3/t;;;17-;;;;;;;;/m...1......../s1
InChIKeyRGFROUYGWPRSEW-LXFUTICHSA-N
MW5495.02 g/mol
LogP71.54
Rot. Bonds91

About tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate

tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate (PubChem CID 160617076) has the molecular formula C300H313ClF12N40O31S8 and a molecular weight of 5495.02 g/mol. Its IUPAC name is tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate
PubChem CID160617076
Molecular FormulaC300H313ClF12N40O31S8
Molecular Weight5495.02 g/mol
Exact Mass5490.14
IUPAC Nametert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(C4CC4)cc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(OCC(F)F)ccc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-n4ccnc4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2CC)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)c(Cl)c1.CCn1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(C(C)C)cc21.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2ccc(OCC(F)F)cc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(CC2CC2)c2cc(OCC(F)F)ccc12
InChIInChI=1S/C27H29N3O2.C26H24ClN5O3S.C26H25N5O2.C26H29N3O2.2C25H27F2N3O3S.C25H25F2N3O3.C25H29N3O2S.2C24H23F2N3O3S.C24H25F2N3O3S.C23H27N3O2S/c1-27(2,3)32-26(31)29-20-12-9-18(10-13-20)25-23(16-28)22-14-11-19(17-7-8-17)15-24(22)30(25)21-5-4-6-21;1-2-13-36(33,34)31-17-7-9-21(23(27)14-17)25-22(16-28)20-10-8-19(35-26-29-11-4-12-30-26)15-24(20)32(25)18-5-3-6-18;1-17(2)33-26(32)29-19-8-6-18(7-9-19)25-23(15-27)22-11-10-21(30-13-12-28-16-30)14-24(22)31(25)20-4-3-5-20;1-5-29-24-14-20(16(2)3)10-13-22(24)23(15-27)25(29)19-8-11-21(12-9-19)28-26(30)31-17(4)18-6-7-18;1-16(2)15-34(31,32)29-19-7-5-18(6-8-19)25-22(12-28)21-10-9-20(33-14-24(26)27)11-23(21)30(25)13-17-3-4-17;1-16(2)15-34(31,32)29-18-8-6-17(7-9-18)25-22(13-28)21-12-20(33-14-24(26)27)10-11-23(21)30(25)19-4-3-5-19;1-15(2)33-25(31)29-18-7-5-17(6-8-18)24-21(12-28)20-10-9-19(32-14-23(26)27)11-22(20)30(24)13-16-3-4-16;1-4-14-31(29,30)27-20-11-8-18(9-12-20)25-23(16-26)22-13-10-19(17(2)3)15-24(22)28(25)21-6-5-7-21;25-23(26)14-32-18-7-10-20-21(12-27)24(29(22(20)11-18)13-15-1-2-15)16-3-5-17(6-4-16)28-33(30,31)19-8-9-19;25-23(26)14-32-18-8-11-22-20(12-18)21(13-27)24(29(22)17-2-1-3-17)15-4-6-16(7-5-15)28-33(30,31)19-9-10-19;1-2-11-33(30,31)28-18-7-5-17(6-8-18)24-21(13-27)20-10-9-19(32-15-23(25)26)12-22(20)29(24)14-16-3-4-16;1-5-13-29(27,28)25-19-10-7-17(8-11-19)23-21(15-24)20-12-9-18(16(3)4)14-22(20)26(23)6-2/h9-15,17,21H,4-8H2,1-3H3,(H,29,31);4,7-12,14-15,18,31H,2-3,5-6,13H2,1H3;6-14,16-17,20H,3-5H2,1-2H3,(H,29,32);8-14,16-18H,5-7H2,1-4H3,(H,28,30);5-11,16-17,24,29H,3-4,13-15H2,1-2H3;6-12,16,19,24,29H,3-5,14-15H2,1-2H3;5-11,15-16,23H,3-4,13-14H2,1-2H3,(H,29,31);8-13,15,17,21,27H,4-7,14H2,1-3H3;3-7,10-11,15,19,23,28H,1-2,8-9,13-14H2;4-8,11-12,17,19,23,28H,1-3,9-10,14H2;5-10,12,16,23,28H,2-4,11,14-15H2,1H3;7-12,14,16,25H,5-6,13H2,1-4H3/t;;;17-;;;;;;;;/m...1......../s1
InChIKeyRGFROUYGWPRSEW-LXFUTICHSA-N
XLogP71.54
TPSA975.53 Ų
H-Bond Donors12
H-Bond Acceptors59
Rotatable Bonds91
Heavy Atoms392
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005495.02
LogP ≤ 571.54
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1059

Analyze tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate?
The IUPAC name of tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate (CID 160617076) is tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate?
The canonical SMILES for tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate is CC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(C4CC4)cc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(OCC(F)F)ccc3n2C2CCC2)cc1.CC(C)CS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-n4ccnc4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(C(C)C)cc3n2CC)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OCC(F)F)cc3n2CC2CC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4ncccn4)cc3n2C2CCC2)c(Cl)c1.CCn1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(C(C)C)cc21.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2ccc(OCC(F)F)cc12.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(CC2CC2)c2cc(OCC(F)F)ccc12.
What is the InChIKey of tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate?
The InChIKey is RGFROUYGWPRSEW-LXFUTICHSA-N. The full InChI is InChI=1S/C27H29N3O2.C26H24ClN5O3S.C26H25N5O2.C26H29N3O2.2C25H27F2N3O3S.C25H25F2N3O3.C25H29N3O2S.2C24H23F2N3O3S.C24H25F2N3O3S.C23H27N3O2S/c1-27(2,3)32-26(31)29-20-12-9-18(10-13-20)25-23(16-28)22-14-11-19(17-7-8-17)15-24(22)30(25)21-5-4-6-21;1-2-13-36(33,34)31-17-7-9-21(23(27)14-17)25-22(16-28)20-10-8-19(35-26-29-11-4-12-30-26)15-24(20)32(25)18-5-3-6-18;1-17(2)33-26(32)29-19-8-6-18(7-9-19)25-23(15-27)22-11-10-21(30-13-12-28-16-30)14-24(22)31(25)20-4-3-5-20;1-5-29-24-14-20(16(2)3)10-13-22(24)23(15-27)25(29)19-8-11-21(12-9-19)28-26(30)31-17(4)18-6-7-18;1-16(2)15-34(31,32)29-19-7-5-18(6-8-19)25-22(12-28)21-10-9-20(33-14-24(26)27)11-23(21)30(25)13-17-3-4-17;1-16(2)15-34(31,32)29-18-8-6-17(7-9-18)25-22(13-28)21-12-20(33-14-24(26)27)10-11-23(21)30(25)19-4-3-5-19;1-15(2)33-25(31)29-18-7-5-17(6-8-18)24-21(12-28)20-10-9-19(32-14-23(26)27)11-22(20)30(24)13-16-3-4-16;1-4-14-31(29,30)27-20-11-8-18(9-12-20)25-23(16-26)22-13-10-19(17(2)3)15-24(22)28(25)21-6-5-7-21;25-23(26)14-32-18-7-10-20-21(12-27)24(29(22(20)11-18)13-15-1-2-15)16-3-5-17(6-4-16)28-33(30,31)19-8-9-19;25-23(26)14-32-18-8-11-22-20(12-18)21(13-27)24(29(22)17-2-1-3-17)15-4-6-16(7-5-15)28-33(30,31)19-9-10-19;1-2-11-33(30,31)28-18-7-5-17(6-8-18)24-21(13-27)20-10-9-19(32-15-23(25)26)12-22(20)29(24)14-16-3-4-16;1-5-13-29(27,28)25-19-10-7-17(8-11-19)23-21(15-24)20-12-9-18(16(3)4)14-22(20)26(23)6-2/h9-15,17,21H,4-8H2,1-3H3,(H,29,31);4,7-12,14-15,18,31H,2-3,5-6,13H2,1H3;6-14,16-17,20H,3-5H2,1-2H3,(H,29,32);8-14,16-18H,5-7H2,1-4H3,(H,28,30);5-11,16-17,24,29H,3-4,13-15H2,1-2H3;6-12,16,19,24,29H,3-5,14-15H2,1-2H3;5-11,15-16,23H,3-4,13-14H2,1-2H3,(H,29,31);8-13,15,17,21,27H,4-7,14H2,1-3H3;3-7,10-11,15,19,23,28H,1-2,8-9,13-14H2;4-8,11-12,17,19,23,28H,1-3,9-10,14H2;5-10,12,16,23,28H,2-4,11,14-15H2,1H3;7-12,14,16,25H,5-6,13H2,1-4H3/t;;;17-;;;;;;;;/m...1......../s1.
What are the key properties of tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate?
tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate has a molecular weight of 5495.02 g/mol, XLogP of 71.54, 91 rotatable bonds, 12 hydrogen bond donors, and 59 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-cyclopropylindol-2-yl)phenyl]carbamate;N-[3-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-5-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-ethyl-6-propan-2-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-imidazol-1-ylindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 160617076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).