N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide

C257H305ClF18N40O24 — CID 159241262

IUPACN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide
SMILESCC(C)(C)CC(=O)Nc1nc2c(Cl)cc(C#N)cc2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C(C)(C)C)C1CC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C1(C)CCC1)C1CC1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(O)c3ccccc3)n(C34CC(C3)C4)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC3CC(C)(F)C3(F)F)n(C3(C)CCC3)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)c(C#N)cc2n1C1(C)CCC1)c1ccccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)c(F)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CCC(C)(CF)CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1.C[C@@H](CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1)c1ccccc1.[C-]#[N+]c1cc(F)c2nc(NC(=O)[C@H]3CC3(C)C)n(C(C)(C)C)c2c1
InChIInChI=1S/C25H29N3O3.C24H29N3O2.C23H24F3N3O3.C23H22F2N4O2.C23H24N4O2.C22H28F3N3O2.C21H26F3N3O2.C21H30FN3O2.C20H26F3N3O2.C19H25F2N3O2.C18H21ClN4O.C18H21FN4O/c1-23(2,30)18-9-10-19-20(11-18)28(25-12-16(13-25)14-25)22(26-19)27-21(29)15-24(3,31)17-7-5-4-6-8-17;1-16(17-8-5-4-6-9-17)14-22(28)26-23-25-20-13-12-18(24(2,3)29)15-21(20)27(23)19-10-7-11-19;1-22(11-6-12-22)29-19-15(9-10-16(18(19)24)32-20(25)26)27-21(29)28-17(30)13-23(2,31)14-7-4-3-5-8-14;1-22(8-5-9-22)29-19-10-14(13-26)17(25)11-18(19)27-21(29)28-20(30)12-23(2,31)15-6-3-4-7-16(15)24;1-22(12-7-13-22)27-20-16(15-24)8-6-11-18(20)25-21(27)26-19(28)14-23(2,29)17-9-4-3-5-10-17;1-19(2,30)13-6-7-15-16(10-13)28(20(3)8-5-9-20)18(26-15)27-17(29)11-14-12-21(4,23)22(14,24)25;1-20(2,12-5-6-12)11-17(28)26-19-25-14-9-13(22)16(29-18(23)24)10-15(14)27(19)21(3)7-4-8-21;1-5-21(4,13-22)12-18(26)24-19-23-16-10-9-14(20(2,3)27)11-17(16)25(19)15-7-6-8-15;1-19(2,3)26-14-9-15(28-17(22)23)12(21)8-13(14)24-18(26)25-16(27)10-20(4,5)11-6-7-11;1-18(2,3)11-15(25)23-17-22-13-7-6-12(26-16(20)21)10-14(13)24(17)19(4)8-5-9-19;1-18(2,3)9-15(24)21-17-22-16-13(19)7-11(10-20)8-14(16)23(17)12-5-4-6-12;1-17(2,3)23-13-8-10(20-6)7-12(19)14(13)21-16(23)22-15(24)11-9-18(11,4)5/h4-11,16,30-31H,12-15H2,1-3H3,(H,26,27,29);4-6,8-9,12-13,15-16,19,29H,7,10-11,14H2,1-3H3,(H,25,26,28);3-5,7-10,20,31H,6,11-13H2,1-2H3,(H,27,28,30);3-4,6-7,10-11,31H,5,8-9,12H2,1-2H3,(H,27,28,30);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);6-7,10,14,30H,5,8-9,11-12H2,1-4H3,(H,26,27,29);9-10,12,18H,4-8,11H2,1-3H3,(H,25,26,28);9-11,15,27H,5-8,12-13H2,1-4H3,(H,23,24,26);8-9,11,17H,6-7,10H2,1-5H3,(H,24,25,27);6-7,10,16H,5,8-9,11H2,1-4H3,(H,22,23,25);7-8,12H,4-6,9H2,1-3H3,(H,21,22,24);7-8,11H,9H2,1-5H3,(H,21,22,24)/t;16-;;;;;;;;;;11-/m.0.........1/s1
InChIKeyKUCXWEXOQZSNIL-MFRQEYJMSA-N
MW4715.94 g/mol
LogP56.76
Rot. Bonds64

About N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide

N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide (PubChem CID 159241262) has the molecular formula C257H305ClF18N40O24 and a molecular weight of 4715.94 g/mol. Its IUPAC name is N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide.

Molecular Properties

Compound NameN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide
PubChem CID159241262
Molecular FormulaC257H305ClF18N40O24
Molecular Weight4715.94 g/mol
Exact Mass4712.33
IUPAC NameN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide
SMILESCC(C)(C)CC(=O)Nc1nc2c(Cl)cc(C#N)cc2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C(C)(C)C)C1CC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C1(C)CCC1)C1CC1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(O)c3ccccc3)n(C34CC(C3)C4)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC3CC(C)(F)C3(F)F)n(C3(C)CCC3)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)c(C#N)cc2n1C1(C)CCC1)c1ccccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)c(F)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CCC(C)(CF)CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1.C[C@@H](CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1)c1ccccc1.[C-]#[N+]c1cc(F)c2nc(NC(=O)[C@H]3CC3(C)C)n(C(C)(C)C)c2c1
InChIInChI=1S/C25H29N3O3.C24H29N3O2.C23H24F3N3O3.C23H22F2N4O2.C23H24N4O2.C22H28F3N3O2.C21H26F3N3O2.C21H30FN3O2.C20H26F3N3O2.C19H25F2N3O2.C18H21ClN4O.C18H21FN4O/c1-23(2,30)18-9-10-19-20(11-18)28(25-12-16(13-25)14-25)22(26-19)27-21(29)15-24(3,31)17-7-5-4-6-8-17;1-16(17-8-5-4-6-9-17)14-22(28)26-23-25-20-13-12-18(24(2,3)29)15-21(20)27(23)19-10-7-11-19;1-22(11-6-12-22)29-19-15(9-10-16(18(19)24)32-20(25)26)27-21(29)28-17(30)13-23(2,31)14-7-4-3-5-8-14;1-22(8-5-9-22)29-19-10-14(13-26)17(25)11-18(19)27-21(29)28-20(30)12-23(2,31)15-6-3-4-7-16(15)24;1-22(12-7-13-22)27-20-16(15-24)8-6-11-18(20)25-21(27)26-19(28)14-23(2,29)17-9-4-3-5-10-17;1-19(2,30)13-6-7-15-16(10-13)28(20(3)8-5-9-20)18(26-15)27-17(29)11-14-12-21(4,23)22(14,24)25;1-20(2,12-5-6-12)11-17(28)26-19-25-14-9-13(22)16(29-18(23)24)10-15(14)27(19)21(3)7-4-8-21;1-5-21(4,13-22)12-18(26)24-19-23-16-10-9-14(20(2,3)27)11-17(16)25(19)15-7-6-8-15;1-19(2,3)26-14-9-15(28-17(22)23)12(21)8-13(14)24-18(26)25-16(27)10-20(4,5)11-6-7-11;1-18(2,3)11-15(25)23-17-22-13-7-6-12(26-16(20)21)10-14(13)24(17)19(4)8-5-9-19;1-18(2,3)9-15(24)21-17-22-16-13(19)7-11(10-20)8-14(16)23(17)12-5-4-6-12;1-17(2,3)23-13-8-10(20-6)7-12(19)14(13)21-16(23)22-15(24)11-9-18(11,4)5/h4-11,16,30-31H,12-15H2,1-3H3,(H,26,27,29);4-6,8-9,12-13,15-16,19,29H,7,10-11,14H2,1-3H3,(H,25,26,28);3-5,7-10,20,31H,6,11-13H2,1-2H3,(H,27,28,30);3-4,6-7,10-11,31H,5,8-9,12H2,1-2H3,(H,27,28,30);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);6-7,10,14,30H,5,8-9,11-12H2,1-4H3,(H,26,27,29);9-10,12,18H,4-8,11H2,1-3H3,(H,25,26,28);9-11,15,27H,5-8,12-13H2,1-4H3,(H,23,24,26);8-9,11,17H,6-7,10H2,1-5H3,(H,24,25,27);6-7,10,16H,5,8-9,11H2,1-4H3,(H,22,23,25);7-8,12H,4-6,9H2,1-3H3,(H,21,22,24);7-8,11H,9H2,1-5H3,(H,21,22,24)/t;16-;;;;;;;;;;11-/m.0.........1/s1
InChIKeyKUCXWEXOQZSNIL-MFRQEYJMSA-N
XLogP56.76
TPSA837.53 Ų
H-Bond Donors20
H-Bond Acceptors51
Rotatable Bonds64
Heavy Atoms340
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004715.94
LogP ≤ 556.76
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1051

Analyze N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide with MolForge

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What is the IUPAC name of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide?
The IUPAC name of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide (CID 159241262) is N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide.
What is the SMILES notation for N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide?
The canonical SMILES for N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide is CC(C)(C)CC(=O)Nc1nc2c(Cl)cc(C#N)cc2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C(C)(C)C)C1CC1.CC(C)(CC(=O)Nc1nc2cc(F)c(OC(F)F)cc2n1C1(C)CCC1)C1CC1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(O)c3ccccc3)n(C34CC(C3)C4)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC3CC(C)(F)C3(F)F)n(C3(C)CCC3)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)c(C#N)cc2n1C1(C)CCC1)c1ccccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)c(F)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CCC(C)(CF)CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1.C[C@@H](CC(=O)Nc1nc2ccc(C(C)(C)O)cc2n1C1CCC1)c1ccccc1.[C-]#[N+]c1cc(F)c2nc(NC(=O)[C@H]3CC3(C)C)n(C(C)(C)C)c2c1.
What is the InChIKey of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide?
The InChIKey is KUCXWEXOQZSNIL-MFRQEYJMSA-N. The full InChI is InChI=1S/C25H29N3O3.C24H29N3O2.C23H24F3N3O3.C23H22F2N4O2.C23H24N4O2.C22H28F3N3O2.C21H26F3N3O2.C21H30FN3O2.C20H26F3N3O2.C19H25F2N3O2.C18H21ClN4O.C18H21FN4O/c1-23(2,30)18-9-10-19-20(11-18)28(25-12-16(13-25)14-25)22(26-19)27-21(29)15-24(3,31)17-7-5-4-6-8-17;1-16(17-8-5-4-6-9-17)14-22(28)26-23-25-20-13-12-18(24(2,3)29)15-21(20)27(23)19-10-7-11-19;1-22(11-6-12-22)29-19-15(9-10-16(18(19)24)32-20(25)26)27-21(29)28-17(30)13-23(2,31)14-7-4-3-5-8-14;1-22(8-5-9-22)29-19-10-14(13-26)17(25)11-18(19)27-21(29)28-20(30)12-23(2,31)15-6-3-4-7-16(15)24;1-22(12-7-13-22)27-20-16(15-24)8-6-11-18(20)25-21(27)26-19(28)14-23(2,29)17-9-4-3-5-10-17;1-19(2,30)13-6-7-15-16(10-13)28(20(3)8-5-9-20)18(26-15)27-17(29)11-14-12-21(4,23)22(14,24)25;1-20(2,12-5-6-12)11-17(28)26-19-25-14-9-13(22)16(29-18(23)24)10-15(14)27(19)21(3)7-4-8-21;1-5-21(4,13-22)12-18(26)24-19-23-16-10-9-14(20(2,3)27)11-17(16)25(19)15-7-6-8-15;1-19(2,3)26-14-9-15(28-17(22)23)12(21)8-13(14)24-18(26)25-16(27)10-20(4,5)11-6-7-11;1-18(2,3)11-15(25)23-17-22-13-7-6-12(26-16(20)21)10-14(13)24(17)19(4)8-5-9-19;1-18(2,3)9-15(24)21-17-22-16-13(19)7-11(10-20)8-14(16)23(17)12-5-4-6-12;1-17(2,3)23-13-8-10(20-6)7-12(19)14(13)21-16(23)22-15(24)11-9-18(11,4)5/h4-11,16,30-31H,12-15H2,1-3H3,(H,26,27,29);4-6,8-9,12-13,15-16,19,29H,7,10-11,14H2,1-3H3,(H,25,26,28);3-5,7-10,20,31H,6,11-13H2,1-2H3,(H,27,28,30);3-4,6-7,10-11,31H,5,8-9,12H2,1-2H3,(H,27,28,30);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);6-7,10,14,30H,5,8-9,11-12H2,1-4H3,(H,26,27,29);9-10,12,18H,4-8,11H2,1-3H3,(H,25,26,28);9-11,15,27H,5-8,12-13H2,1-4H3,(H,23,24,26);8-9,11,17H,6-7,10H2,1-5H3,(H,24,25,27);6-7,10,16H,5,8-9,11H2,1-4H3,(H,22,23,25);7-8,12H,4-6,9H2,1-3H3,(H,21,22,24);7-8,11H,9H2,1-5H3,(H,21,22,24)/t;16-;;;;;;;;;;11-/m.0.........1/s1.
What are the key properties of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide?
N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide has a molecular weight of 4715.94 g/mol, XLogP of 56.76, 64 rotatable bonds, 20 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-tert-butyl-6-(difluoromethoxy)-5-fluorobenzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;(1S)-N-(1-tert-butyl-4-fluoro-6-isocyanobenzimidazol-2-yl)-2,2-dimethylcyclopropane-1-carboxamide;N-(4-chloro-6-cyano-1-cyclobutylbenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2-fluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-(fluoromethyl)-3-methylpentanamide;(3S)-N-[1-cyclobutyl-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-phenylbutanamide;3-cyclopropyl-N-[6-(difluoromethoxy)-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-methylbutanamide;N-[6-(difluoromethoxy)-7-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[6-(2-hydroxypropan-2-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-2-(2,2,3-trifluoro-3-methylcyclobutyl)acetamide is sourced from PubChem (CID 159241262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).