N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide

C142H139ClF4N18O10S3 — CID 167583565

About N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide

N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide (PubChem CID 167583565) has the molecular formula C142H139ClF4N18O10S3 and a molecular weight of 2465.44 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide.

Molecular Properties

• Compound Name: N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide
• PubChem CID: 167583565
• Molecular Formula: C142H139ClF4N18O10S3
• Molecular Weight: 2465.44 g/mol
• Exact Mass: 2462.97
• IUPAC Name: N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide
• SMILES: C#Cc1ccc(C(=O)C[C@@H]2CCC[C@H](n3c(-c4ccccc4C(F)F)nc4cc(C(=O)CC)ccc43)C2)s1.CCC(=O)c1ccc2c(c1)nc(-c1ccccc1C(F)F)n2[C@H]1CCC[C@@H](CC(=O)c2ccc(C)s2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Cc2ccc(C)s2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Nc2ccccc2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Nc2ccccc2Cl)C1
• InChI: InChI=1S/C31H28F2N2O2S.C30H30F2N2O2S.C27H26ClN5O2.C27H27N5O2.C27H28N4O2S/c1-3-22-13-15-29(38-22)28(37)17-19-8-7-9-21(16-19)35-26-14-12-20(27(36)4-2)18-25(26)34-31(35)24-11-6-5-10-23(24)30(32)33;1-3-26(35)20-12-13-25-24(17-20)33-30(23-10-5-4-9-22(23)29(31)32)34(25)21-8-6-7-19(15-21)16-27(36)28-14-11-18(2)37-28;1-2-25(34)18-12-13-24-23(16-18)30-26(22-11-5-6-14-29-22)33(24)19-8-7-15-32(17-19)27(35)31-21-10-4-3-9-20(21)28;1-2-25(33)19-13-14-24-23(17-19)30-26(22-12-6-7-15-28-22)32(24)21-11-8-16-31(18-21)27(34)29-20-9-4-3-5-10-20;1-3-25(32)19-10-12-24-23(15-19)29-27(22-8-4-5-13-28-22)31(24)20-7-6-14-30(17-20)26(33)16-21-11-9-18(2)34-21/h1,5-6,10-15,18-19,21,30H,4,7-9,16-17H2,2H3;4-5,9-14,17,19,21,29H,3,6-8,15-16H2,1-2H3;3-6,9-14,16,19H,2,7-8,15,17H2,1H3,(H,31,35);3-7,9-10,12-15,17,21H,2,8,11,16,18H2,1H3,(H,29,34);4-5,8-13,15,20H,3,6-7,14,16-17H2,1-2H3/t2*19-,21+;;;/m11.../s1
• InChIKey: HMMIONNVRHAJCB-OPTWZUNCSA-N
• XLogP: 34.13
• TPSA: 332.25 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 26
• Rotatable Bonds: 32
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2465.44
LogP ≤ 5	34.13
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide?

The IUPAC name of N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide (CID 167583565) is N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide.

What is the SMILES notation for N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide?

The canonical SMILES for N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide is C#Cc1ccc(C(=O)C[C@@H]2CCC[C@H](n3c(-c4ccccc4C(F)F)nc4cc(C(=O)CC)ccc43)C2)s1.CCC(=O)c1ccc2c(c1)nc(-c1ccccc1C(F)F)n2[C@H]1CCC[C@@H](CC(=O)c2ccc(C)s2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Cc2ccc(C)s2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Nc2ccccc2)C1.CCC(=O)c1ccc2c(c1)nc(-c1ccccn1)n2C1CCCN(C(=O)Nc2ccccc2Cl)C1.

What is the InChIKey of N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide?

The InChIKey is HMMIONNVRHAJCB-OPTWZUNCSA-N. The full InChI is InChI=1S/C31H28F2N2O2S.C30H30F2N2O2S.C27H26ClN5O2.C27H27N5O2.C27H28N4O2S/c1-3-22-13-15-29(38-22)28(37)17-19-8-7-9-21(16-19)35-26-14-12-20(27(36)4-2)18-25(26)34-31(35)24-11-6-5-10-23(24)30(32)33;1-3-26(35)20-12-13-25-24(17-20)33-30(23-10-5-4-9-22(23)29(31)32)34(25)21-8-6-7-19(15-21)16-27(36)28-14-11-18(2)37-28;1-2-25(34)18-12-13-24-23(16-18)30-26(22-11-5-6-14-29-22)33(24)19-8-7-15-32(17-19)27(35)31-21-10-4-3-9-20(21)28;1-2-25(33)19-13-14-24-23(17-19)30-26(22-12-6-7-15-28-22)32(24)21-11-8-16-31(18-21)27(34)29-20-9-4-3-5-10-20;1-3-25(32)19-10-12-24-23(15-19)29-27(22-8-4-5-13-28-22)31(24)20-7-6-14-30(17-20)26(33)16-21-11-9-18(2)34-21/h1,5-6,10-15,18-19,21,30H,4,7-9,16-17H2,2H3;4-5,9-14,17,19,21,29H,3,6-8,15-16H2,1-2H3;3-6,9-14,16,19H,2,7-8,15,17H2,1H3,(H,31,35);3-7,9-10,12-15,17,21H,2,8,11,16,18H2,1H3,(H,29,34);4-5,8-13,15,20H,3,6-7,14,16-17H2,1-2H3/t2*19-,21+;;;/m11.../s1.

What are the key properties of N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide?

N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide has a molecular weight of 2465.44 g/mol, XLogP of 34.13, 32 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-chlorophenyl)-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-ethynylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[2-[2-(difluoromethyl)phenyl]-1-[(1S,3R)-3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]cyclohexyl]benzimidazol-5-yl]propan-1-one;1-[1-[1-[2-(5-methylthiophen-2-yl)acetyl]piperidin-3-yl]-2-pyridin-2-ylbenzimidazol-5-yl]propan-1-one;N-phenyl-3-(5-propanoyl-2-pyridin-2-ylbenzimidazol-1-yl)piperidine-1-carboxamide is sourced from PubChem (CID 167583565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).