N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide

C₁₀₇H₁₂₀F₁₂N₂₂O₁₂ — CID 157088496

About N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide

N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide (PubChem CID 157088496) has the molecular formula C₁₀₇H₁₂₀F₁₂N₂₂O₁₂ and a molecular weight of 2134.25 g/mol. Its IUPAC name is N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide.

Molecular Properties

• Compound Name: N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide
• PubChem CID: 157088496
• Molecular Formula: C₁₀₇H₁₂₀F₁₂N₂₂O₁₂
• Molecular Weight: 2134.25 g/mol
• Exact Mass: 2132.93
• IUPAC Name: N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide
• SMILES: C[C@@](O)(C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C(F)(F)F.Cc1cc(-n2c(NC(=O)CC(C)(C)C)nc3ccc(C(F)(F)F)cc32)on1.Cc1cc(-n2c(NC(=O)[C@@H](C)C(C)(C)C)nc3ccc(C(F)(F)F)cc32)on1.Cc1ccc2nc(NC(=O)CC3(O)CCC3)n(C3CCC3)c2c1.Cc1ccc2nc(NC(=O)[C@@H](C)C(C)C)n(-c3cc(C)no3)c2c1.Cc1ccc2nc(NC(=O)[C@H]3CC3(C)C)n(-c3cc(C)no3)c2c1
• InChI: InChI=1S/C19H21F3N4O2.C18H19F3N4O2.C18H20N4O2.C18H22N4O2.C18H23N3O2.C16H15F6N3O2/c1-10-8-15(28-25-10)26-14-9-12(19(20,21)22)6-7-13(14)23-17(26)24-16(27)11(2)18(3,4)5;1-10-7-15(27-24-10)25-13-8-11(18(19,20)21)5-6-12(13)22-16(25)23-14(26)9-17(2,3)4;1-10-5-6-13-14(7-10)22(15-8-11(2)21-24-15)17(19-13)20-16(23)12-9-18(12,3)4;1-10(2)13(5)17(23)20-18-19-14-7-6-11(3)8-15(14)22(18)16-9-12(4)21-24-16;1-12-6-7-14-15(10-12)21(13-4-2-5-13)17(19-14)20-16(22)11-18(23)8-3-9-18;1-14(27,16(20,21)22)12(26)24-13-23-10-6-5-8(15(17,18)19)7-11(10)25(13)9-3-2-4-9/h6-9,11H,1-5H3,(H,23,24,27);5-8H,9H2,1-4H3,(H,22,23,26);5-8,12H,9H2,1-4H3,(H,19,20,23);6-10,13H,1-5H3,(H,19,20,23);6-7,10,13,23H,2-5,8-9,11H2,1H3,(H,19,20,22);5-7,9,27H,2-4H2,1H3,(H,23,24,26)/t11-;;12-;13-;;14-/m1.10.1/s1
• InChIKey: AEJKUHMBXTUBHX-WWWLKFFLSA-N
• XLogP: 24.50
• TPSA: 426.10 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 28
• Rotatable Bonds: 20
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2134.25
LogP ≤ 5	24.50
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide?

The IUPAC name of N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide (CID 157088496) is N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide.

What is the SMILES notation for N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide?

The canonical SMILES for N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide is C[C@@](O)(C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C(F)(F)F.Cc1cc(-n2c(NC(=O)CC(C)(C)C)nc3ccc(C(F)(F)F)cc32)on1.Cc1cc(-n2c(NC(=O)[C@@H](C)C(C)(C)C)nc3ccc(C(F)(F)F)cc32)on1.Cc1ccc2nc(NC(=O)CC3(O)CCC3)n(C3CCC3)c2c1.Cc1ccc2nc(NC(=O)[C@@H](C)C(C)C)n(-c3cc(C)no3)c2c1.Cc1ccc2nc(NC(=O)[C@H]3CC3(C)C)n(-c3cc(C)no3)c2c1.

What is the InChIKey of N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide?

The InChIKey is AEJKUHMBXTUBHX-WWWLKFFLSA-N. The full InChI is InChI=1S/C19H21F3N4O2.C18H19F3N4O2.C18H20N4O2.C18H22N4O2.C18H23N3O2.C16H15F6N3O2/c1-10-8-15(28-25-10)26-14-9-12(19(20,21)22)6-7-13(14)23-17(26)24-16(27)11(2)18(3,4)5;1-10-7-15(27-24-10)25-13-8-11(18(19,20)21)5-6-12(13)22-16(25)23-14(26)9-17(2,3)4;1-10-5-6-13-14(7-10)22(15-8-11(2)21-24-15)17(19-13)20-16(23)12-9-18(12,3)4;1-10(2)13(5)17(23)20-18-19-14-7-6-11(3)8-15(14)22(18)16-9-12(4)21-24-16;1-12-6-7-14-15(10-12)21(13-4-2-5-13)17(19-14)20-16(22)11-18(23)8-3-9-18;1-14(27,16(20,21)22)12(26)24-13-23-10-6-5-8(15(17,18)19)7-11(10)25(13)9-3-2-4-9/h6-9,11H,1-5H3,(H,23,24,27);5-8H,9H2,1-4H3,(H,22,23,26);5-8,12H,9H2,1-4H3,(H,19,20,23);6-10,13H,1-5H3,(H,19,20,23);6-7,10,13,23H,2-5,8-9,11H2,1H3,(H,19,20,22);5-7,9,27H,2-4H2,1H3,(H,23,24,26)/t11-;;12-;13-;;14-/m1.10.1/s1.

What are the key properties of N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide?

N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide has a molecular weight of 2134.25 g/mol, XLogP of 24.50, 20 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1-cyclobutyl-6-methylbenzimidazol-2-yl)-2-(1-hydroxycyclobutyl)acetamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;(2S)-2,3-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]butanamide;(1S)-2,2-dimethyl-N-[6-methyl-1-(3-methyl-1,2-oxazol-5-yl)benzimidazol-2-yl]cyclopropane-1-carboxamide;3,3-dimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide;(2S)-2,3,3-trimethyl-N-[1-(3-methyl-1,2-oxazol-5-yl)-6-(trifluoromethyl)benzimidazol-2-yl]butanamide is sourced from PubChem (CID 157088496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 157088496 — identifiers, structure, computed properties (public domain)

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