N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide

C253H289BrF18N42O22 — CID 158794745

IUPACN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide
SMILESCC(C)(C)CC(=O)Nc1nc2ccc(F)c(Br)c2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1.CC(C)(O)c1c(F)cc2nc(NC(=O)CC(C)(C)C(F)(F)F)n(C3CCC3)c2c1F.CC(C)(O)c1cc(F)c2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(C)C3CC3)n(C34CC(C3)C4)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)cc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2ccc(C#N)cc2n1C1(C)CCC1)c1c(F)cccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC1(Cn2c(NC(=O)CC(C)(O)c3ccccc3)nc3ccc(C#N)cc32)CC1.COc1cc(F)c2nc(NC(=O)CC(C)(C)C)n(C3CCC3)c2c1.[C-]#[N+]c1cc(F)c2nc(NC(=O)CC(C)(C)C3CC3)n(C3CCC3)c2c1F
InChIInChI=1S/C23H22F2N4O2.C23H25F2N3O3.C23H23FN4O2.2C23H24N4O2.C23H31N3O2.C21H25F4N3O2.C20H24F5N3O2.C20H22F2N4O.C19H24N4O.C18H24FN3O2.C17H21BrFN3O/c1-22(9-4-10-22)29-18-11-14(13-26)7-8-17(18)27-21(29)28-19(30)12-23(2,31)20-15(24)5-3-6-16(20)25;1-22(11-6-12-22)28-18-13-16(31-20(24)25)9-10-17(18)26-21(28)27-19(29)14-23(2,30)15-7-4-3-5-8-15;1-22(9-6-10-22)28-20-15(14-25)11-17(24)12-18(20)26-21(28)27-19(29)13-23(2,30)16-7-4-3-5-8-16;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;1-22(10-11-22)15-27-19-12-16(14-24)8-9-18(19)25-21(27)26-20(28)13-23(2,29)17-6-4-3-5-7-17;1-21(2,15-5-6-15)13-19(27)25-20-24-17-8-7-16(22(3,4)28)9-18(17)26(20)23-10-14(11-23)12-23;1-19(2,30)11-7-14(22)17-15(8-11)28(13-5-4-6-13)18(27-17)26-16(29)9-12-10-21(24,25)20(12,3)23;1-18(2,20(23,24)25)9-13(29)27-17-26-12-8-11(21)14(19(3,4)30)15(22)16(12)28(17)10-6-5-7-10;1-20(2,11-7-8-11)10-15(27)24-19-25-17-13(21)9-14(23-3)16(22)18(17)26(19)12-5-4-6-12;1-18(2,3)11-15(24)22-17-21-14-8-5-7-13(12-20)16(14)23(17)19(4)9-6-10-19;1-18(2,3)10-15(23)20-17-21-16-13(19)8-12(24-4)9-14(16)22(17)11-6-5-7-11;1-17(2,3)9-13(23)21-16-20-12-8-7-11(19)14(18)15(12)22(16)10-5-4-6-10/h3,5-8,11,31H,4,9-10,12H2,1-2H3,(H,27,28,30);3-5,7-10,13,20,30H,6,11-12,14H2,1-2H3,(H,26,27,29);3-5,7-8,11-12,30H,6,9-10,13H2,1-2H3,(H,26,27,29);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);3-9,12,29H,10-11,13,15H2,1-2H3,(H,25,26,28);7-9,14-15,28H,5-6,10-13H2,1-4H3,(H,24,25,27);7-8,12-13,30H,4-6,9-10H2,1-3H3,(H,26,27,29);8,10,30H,5-7,9H2,1-4H3,(H,26,27,29);9,11-12H,4-8,10H2,1-2H3,(H,24,25,27);5,7-8H,6,9-11H2,1-4H3,(H,21,22,24);8-9,11H,5-7,10H2,1-4H3,(H,20,21,23);7-8,10H,4-6,9H2,1-3H3,(H,20,21,23)
InChIKeyISSNRACQXHYRGD-UHFFFAOYSA-N
MW4692.24 g/mol
LogP54.68
Rot. Bonds59

About N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide

N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide (PubChem CID 158794745) has the molecular formula C253H289BrF18N42O22 and a molecular weight of 4692.24 g/mol. Its IUPAC name is N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide.

Molecular Properties

Compound NameN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide
PubChem CID158794745
Molecular FormulaC253H289BrF18N42O22
Molecular Weight4692.24 g/mol
Exact Mass4688.17
IUPAC NameN-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide
SMILESCC(C)(C)CC(=O)Nc1nc2ccc(F)c(Br)c2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1.CC(C)(O)c1c(F)cc2nc(NC(=O)CC(C)(C)C(F)(F)F)n(C3CCC3)c2c1F.CC(C)(O)c1cc(F)c2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(C)C3CC3)n(C34CC(C3)C4)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)cc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2ccc(C#N)cc2n1C1(C)CCC1)c1c(F)cccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC1(Cn2c(NC(=O)CC(C)(O)c3ccccc3)nc3ccc(C#N)cc32)CC1.COc1cc(F)c2nc(NC(=O)CC(C)(C)C)n(C3CCC3)c2c1.[C-]#[N+]c1cc(F)c2nc(NC(=O)CC(C)(C)C3CC3)n(C3CCC3)c2c1F
InChIInChI=1S/C23H22F2N4O2.C23H25F2N3O3.C23H23FN4O2.2C23H24N4O2.C23H31N3O2.C21H25F4N3O2.C20H24F5N3O2.C20H22F2N4O.C19H24N4O.C18H24FN3O2.C17H21BrFN3O/c1-22(9-4-10-22)29-18-11-14(13-26)7-8-17(18)27-21(29)28-19(30)12-23(2,31)20-15(24)5-3-6-16(20)25;1-22(11-6-12-22)28-18-13-16(31-20(24)25)9-10-17(18)26-21(28)27-19(29)14-23(2,30)15-7-4-3-5-8-15;1-22(9-6-10-22)28-20-15(14-25)11-17(24)12-18(20)26-21(28)27-19(29)13-23(2,30)16-7-4-3-5-8-16;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;1-22(10-11-22)15-27-19-12-16(14-24)8-9-18(19)25-21(27)26-20(28)13-23(2,29)17-6-4-3-5-7-17;1-21(2,15-5-6-15)13-19(27)25-20-24-17-8-7-16(22(3,4)28)9-18(17)26(20)23-10-14(11-23)12-23;1-19(2,30)11-7-14(22)17-15(8-11)28(13-5-4-6-13)18(27-17)26-16(29)9-12-10-21(24,25)20(12,3)23;1-18(2,20(23,24)25)9-13(29)27-17-26-12-8-11(21)14(19(3,4)30)15(22)16(12)28(17)10-6-5-7-10;1-20(2,11-7-8-11)10-15(27)24-19-25-17-13(21)9-14(23-3)16(22)18(17)26(19)12-5-4-6-12;1-18(2,3)11-15(24)22-17-21-14-8-5-7-13(12-20)16(14)23(17)19(4)9-6-10-19;1-18(2,3)10-15(23)20-17-21-16-13(19)8-12(24-4)9-14(16)22(17)11-6-5-7-11;1-17(2,3)9-13(23)21-16-20-12-8-7-11(19)14(18)15(12)22(16)10-5-4-6-10/h3,5-8,11,31H,4,9-10,12H2,1-2H3,(H,27,28,30);3-5,7-10,13,20,30H,6,11-12,14H2,1-2H3,(H,26,27,29);3-5,7-8,11-12,30H,6,9-10,13H2,1-2H3,(H,26,27,29);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);3-9,12,29H,10-11,13,15H2,1-2H3,(H,25,26,28);7-9,14-15,28H,5-6,10-13H2,1-4H3,(H,24,25,27);7-8,12-13,30H,4-6,9-10H2,1-3H3,(H,26,27,29);8,10,30H,5-7,9H2,1-4H3,(H,26,27,29);9,11-12H,4-8,10H2,1-2H3,(H,24,25,27);5,7-8H,6,9-11H2,1-4H3,(H,21,22,24);8-9,11H,5-7,10H2,1-4H3,(H,20,21,23);7-8,10H,4-6,9H2,1-3H3,(H,20,21,23)
InChIKeyISSNRACQXHYRGD-UHFFFAOYSA-N
XLogP54.68
TPSA866.65 Ų
H-Bond Donors20
H-Bond Acceptors51
Rotatable Bonds59
Heavy Atoms336
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004692.24
LogP ≤ 554.68
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-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide 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-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide?
The IUPAC name of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide (CID 158794745) is N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide.
What is the SMILES notation for N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide?
The canonical SMILES for N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide is CC(C)(C)CC(=O)Nc1nc2ccc(F)c(Br)c2n1C1CCC1.CC(C)(C)CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1.CC(C)(O)c1c(F)cc2nc(NC(=O)CC(C)(C)C(F)(F)F)n(C3CCC3)c2c1F.CC(C)(O)c1cc(F)c2nc(NC(=O)CC3CC(F)(F)C3(C)F)n(C3CCC3)c2c1.CC(C)(O)c1ccc2nc(NC(=O)CC(C)(C)C3CC3)n(C34CC(C3)C4)c2c1.CC(O)(CC(=O)Nc1nc2cc(F)cc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2ccc(C#N)cc2n1C1(C)CCC1)c1c(F)cccc1F.CC(O)(CC(=O)Nc1nc2ccc(OC(F)F)cc2n1C1(C)CCC1)c1ccccc1.CC(O)(CC(=O)Nc1nc2cccc(C#N)c2n1C1(C)CCC1)c1ccccc1.CC1(Cn2c(NC(=O)CC(C)(O)c3ccccc3)nc3ccc(C#N)cc32)CC1.COc1cc(F)c2nc(NC(=O)CC(C)(C)C)n(C3CCC3)c2c1.[C-]#[N+]c1cc(F)c2nc(NC(=O)CC(C)(C)C3CC3)n(C3CCC3)c2c1F.
What is the InChIKey of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide?
The InChIKey is ISSNRACQXHYRGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F2N4O2.C23H25F2N3O3.C23H23FN4O2.2C23H24N4O2.C23H31N3O2.C21H25F4N3O2.C20H24F5N3O2.C20H22F2N4O.C19H24N4O.C18H24FN3O2.C17H21BrFN3O/c1-22(9-4-10-22)29-18-11-14(13-26)7-8-17(18)27-21(29)28-19(30)12-23(2,31)20-15(24)5-3-6-16(20)25;1-22(11-6-12-22)28-18-13-16(31-20(24)25)9-10-17(18)26-21(28)27-19(29)14-23(2,30)15-7-4-3-5-8-15;1-22(9-6-10-22)28-20-15(14-25)11-17(24)12-18(20)26-21(28)27-19(29)13-23(2,30)16-7-4-3-5-8-16;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;1-22(10-11-22)15-27-19-12-16(14-24)8-9-18(19)25-21(27)26-20(28)13-23(2,29)17-6-4-3-5-7-17;1-21(2,15-5-6-15)13-19(27)25-20-24-17-8-7-16(22(3,4)28)9-18(17)26(20)23-10-14(11-23)12-23;1-19(2,30)11-7-14(22)17-15(8-11)28(13-5-4-6-13)18(27-17)26-16(29)9-12-10-21(24,25)20(12,3)23;1-18(2,20(23,24)25)9-13(29)27-17-26-12-8-11(21)14(19(3,4)30)15(22)16(12)28(17)10-6-5-7-10;1-20(2,11-7-8-11)10-15(27)24-19-25-17-13(21)9-14(23-3)16(22)18(17)26(19)12-5-4-6-12;1-18(2,3)11-15(24)22-17-21-14-8-5-7-13(12-20)16(14)23(17)19(4)9-6-10-19;1-18(2,3)10-15(23)20-17-21-16-13(19)8-12(24-4)9-14(16)22(17)11-6-5-7-11;1-17(2,3)9-13(23)21-16-20-12-8-7-11(19)14(18)15(12)22(16)10-5-4-6-10/h3,5-8,11,31H,4,9-10,12H2,1-2H3,(H,27,28,30);3-5,7-10,13,20,30H,6,11-12,14H2,1-2H3,(H,26,27,29);3-5,7-8,11-12,30H,6,9-10,13H2,1-2H3,(H,26,27,29);3-6,8-11,29H,7,12-14H2,1-2H3,(H,25,26,28);3-9,12,29H,10-11,13,15H2,1-2H3,(H,25,26,28);7-9,14-15,28H,5-6,10-13H2,1-4H3,(H,24,25,27);7-8,12-13,30H,4-6,9-10H2,1-3H3,(H,26,27,29);8,10,30H,5-7,9H2,1-4H3,(H,26,27,29);9,11-12H,4-8,10H2,1-2H3,(H,24,25,27);5,7-8H,6,9-11H2,1-4H3,(H,21,22,24);8-9,11H,5-7,10H2,1-4H3,(H,20,21,23);7-8,10H,4-6,9H2,1-3H3,(H,20,21,23).
What are the key properties of N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide?
N-[1-(1-bicyclo[1.1.1]pentanyl)-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-3-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide has a molecular weight of 4692.24 g/mol, XLogP of 54.68, 59 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-cyclopropyl-3-methylbutanamide;N-(7-bromo-1-cyclobutyl-6-fluorobenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[7-cyano-5-fluoro-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-(2,6-difluorophenyl)-3-hydroxybutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3,3-dimethylbutanamide;N-[7-cyano-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[6-cyano-1-[(1-methylcyclopropyl)methyl]benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide;N-[1-cyclobutyl-5,7-difluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-4,4,4-trifluoro-3,3-dimethylbutanamide;N-(1-cyclobutyl-4,7-difluoro-6-isocyanobenzimidazol-2-yl)-3-cyclopropyl-3-methylbutanamide;N-[1-cyclobutyl-4-fluoro-6-(2-hydroxypropan-2-yl)benzimidazol-2-yl]-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide;N-(1-cyclobutyl-4-fluoro-6-methoxybenzimidazol-2-yl)-3,3-dimethylbutanamide;N-[6-(difluoromethoxy)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-3-hydroxy-3-phenylbutanamide is sourced from PubChem (CID 158794745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).