N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide

C105H109F29N18O8 — CID 158691847

About N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide

N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide (PubChem CID 158691847) has the molecular formula C105H109F29N18O8 and a molecular weight of 2302.09 g/mol. Its IUPAC name is N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide
• PubChem CID: 158691847
• Molecular Formula: C105H109F29N18O8
• Molecular Weight: 2302.09 g/mol
• Exact Mass: 2300.82
• IUPAC Name: N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide
• SMILES: CC(C)(O)[C@H]1C[C@@H]1C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.CC(C)[C@@H](C)C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.CC1(C)C[C@@H]1C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.C[C@](O)(C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C(F)(F)F.O=C(CC(C(F)(F)F)C(F)(F)F)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.O=C(Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C1CC(F)(F)C1
• InChI: InChI=1S/C19H22F3N3O2.C18H20F3N3O.C18H22F3N3O.C17H14F9N3O.C17H16F5N3O.C16H15F6N3O2/c1-18(2,27)13-9-12(13)16(26)24-17-23-14-7-6-10(19(20,21)22)8-15(14)25(17)11-4-3-5-11;1-17(2)9-12(17)15(25)23-16-22-13-7-6-10(18(19,20)21)8-14(13)24(16)11-4-3-5-11;1-10(2)11(3)16(25)23-17-22-14-8-7-12(18(19,20)21)9-15(14)24(17)13-5-4-6-13;18-15(19,20)8-4-5-10-11(6-8)29(9-2-1-3-9)14(27-10)28-13(30)7-12(16(21,22)23)17(24,25)26;18-16(19)7-9(8-16)14(26)24-15-23-12-5-4-10(17(20,21)22)6-13(12)25(15)11-2-1-3-11;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/h6-8,11-13,27H,3-5,9H2,1-2H3,(H,23,24,26);6-8,11-12H,3-5,9H2,1-2H3,(H,22,23,25);7-11,13H,4-6H2,1-3H3,(H,22,23,25);4-6,9,12H,1-3,7H2,(H,27,28,30);4-6,9,11H,1-3,7-8H2,(H,23,24,26);5-7,9,27H,2-4H2,1H3,(H,23,24,26)/t12-,13-;12-;11-;;;14-/m011..0/s1
• InChIKey: IGLHRQDXVHJXQV-OTWPNGJCSA-N
• XLogP: 28.55
• TPSA: 321.98 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 21
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2302.09
LogP ≤ 5	28.55
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide?

The IUPAC name of N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide (CID 158691847) is N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide.

What is the SMILES notation for N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide?

The canonical SMILES for N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide is CC(C)(O)[C@H]1C[C@@H]1C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.CC(C)[C@@H](C)C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.CC1(C)C[C@@H]1C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.C[C@](O)(C(=O)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C(F)(F)F.O=C(CC(C(F)(F)F)C(F)(F)F)Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1.O=C(Nc1nc2ccc(C(F)(F)F)cc2n1C1CCC1)C1CC(F)(F)C1.

What is the InChIKey of N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide?

The InChIKey is IGLHRQDXVHJXQV-OTWPNGJCSA-N. The full InChI is InChI=1S/C19H22F3N3O2.C18H20F3N3O.C18H22F3N3O.C17H14F9N3O.C17H16F5N3O.C16H15F6N3O2/c1-18(2,27)13-9-12(13)16(26)24-17-23-14-7-6-10(19(20,21)22)8-15(14)25(17)11-4-3-5-11;1-17(2)9-12(17)15(25)23-16-22-13-7-6-10(18(19,20)21)8-14(13)24(16)11-4-3-5-11;1-10(2)11(3)16(25)23-17-22-14-8-7-12(18(19,20)21)9-15(14)24(17)13-5-4-6-13;18-15(19,20)8-4-5-10-11(6-8)29(9-2-1-3-9)14(27-10)28-13(30)7-12(16(21,22)23)17(24,25)26;18-16(19)7-9(8-16)14(26)24-15-23-12-5-4-10(17(20,21)22)6-13(12)25(15)11-2-1-3-11;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/h6-8,11-13,27H,3-5,9H2,1-2H3,(H,23,24,26);6-8,11-12H,3-5,9H2,1-2H3,(H,22,23,25);7-11,13H,4-6H2,1-3H3,(H,22,23,25);4-6,9,12H,1-3,7H2,(H,27,28,30);4-6,9,11H,1-3,7-8H2,(H,23,24,26);5-7,9,27H,2-4H2,1H3,(H,23,24,26)/t12-,13-;12-;11-;;;14-/m011..0/s1.

What are the key properties of N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide?

N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 2302.09 g/mol, XLogP of 28.55, 21 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3-difluorocyclobutane-1-carboxamide;(2R)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,3-dimethylbutanamide;(1S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2,2-dimethylcyclopropane-1-carboxamide;(2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide;N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-4,4,4-trifluoro-3-(trifluoromethyl)butanamide;trans-(1S,2S)-N-[1-cyclobutyl-6-(trifluoromethyl)benzimidazol-2-yl]-2-(2-hydroxypropan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 158691847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).