N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide

C85H86ClFN26O9 — CID 158839068

About N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide

N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide (PubChem CID 158839068) has the molecular formula C85H86ClFN26O9 and a molecular weight of 1670.25 g/mol. Its IUPAC name is N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide.

Molecular Properties

• Compound Name: N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide
• PubChem CID: 158839068
• Molecular Formula: C85H86ClFN26O9
• Molecular Weight: 1670.25 g/mol
• Exact Mass: 1668.67
• IUPAC Name: N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide
• SMILES: COc1cc2nc(-c3[nH]ncc3NC(=O)c3cc(C)c[nH]c3=O)[nH]c2cc1OC.Cc1cccc(F)c1C(=O)Nc1cn[nH]c1-c1nc2cc(Cl)ncc2[nH]1.O=C(Nc1ccccc1)Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)C1=CC=C(CN2CCCCC2)C1
• InChI: InChI=1S/C27H33N7O2.C22H23N7O2.C19H18N6O4.C17H12ClFN6O/c35-27(21-6-4-19(14-21)17-33-8-2-1-3-9-33)31-24-16-28-32-25(24)26-29-22-7-5-20(15-23(22)30-26)18-34-10-12-36-13-11-34;30-22(24-16-4-2-1-3-5-16)27-19-13-23-28-20(19)21-25-17-7-6-15(12-18(17)26-21)14-29-8-10-31-11-9-29;1-9-4-10(18(26)20-7-9)19(27)24-13-8-21-25-16(13)17-22-11-5-14(28-2)15(29-3)6-12(11)23-17;1-8-3-2-4-9(19)14(8)17(26)24-12-7-21-25-15(12)16-22-10-5-13(18)20-6-11(10)23-16/h4-7,15-16H,1-3,8-14,17-18H2,(H,28,32)(H,29,30)(H,31,35);1-7,12-13H,8-11,14H2,(H,23,28)(H,25,26)(H2,24,27,30);4-8H,1-3H3,(H,20,26)(H,21,25)(H,22,23)(H,24,27);2-7H,1H3,(H,21,25)(H,22,23)(H,24,26)
• InChIKey: IXZUURSQMAWBAZ-UHFFFAOYSA-N
• XLogP: 12.82
• TPSA: 450.26 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 21
• Rotatable Bonds: 20
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1670.25
LogP ≤ 5	12.82
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide?

The IUPAC name of N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide (CID 158839068) is N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide.

What is the SMILES notation for N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide?

The canonical SMILES for N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide is COc1cc2nc(-c3[nH]ncc3NC(=O)c3cc(C)c[nH]c3=O)[nH]c2cc1OC.Cc1cccc(F)c1C(=O)Nc1cn[nH]c1-c1nc2cc(Cl)ncc2[nH]1.O=C(Nc1ccccc1)Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)C1=CC=C(CN2CCCCC2)C1.

What is the InChIKey of N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide?

The InChIKey is IXZUURSQMAWBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N7O2.C22H23N7O2.C19H18N6O4.C17H12ClFN6O/c35-27(21-6-4-19(14-21)17-33-8-2-1-3-9-33)31-24-16-28-32-25(24)26-29-22-7-5-20(15-23(22)30-26)18-34-10-12-36-13-11-34;30-22(24-16-4-2-1-3-5-16)27-19-13-23-28-20(19)21-25-17-7-6-15(12-18(17)26-21)14-29-8-10-31-11-9-29;1-9-4-10(18(26)20-7-9)19(27)24-13-8-21-25-16(13)17-22-11-5-14(28-2)15(29-3)6-12(11)23-17;1-8-3-2-4-9(19)14(8)17(26)24-12-7-21-25-15(12)16-22-10-5-13(18)20-6-11(10)23-16/h4-7,15-16H,1-3,8-14,17-18H2,(H,28,32)(H,29,30)(H,31,35);1-7,12-13H,8-11,14H2,(H,23,28)(H,25,26)(H2,24,27,30);4-8H,1-3H3,(H,20,26)(H,21,25)(H,22,23)(H,24,27);2-7H,1H3,(H,21,25)(H,22,23)(H,24,26).

What are the key properties of N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide?

N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide has a molecular weight of 1670.25 g/mol, XLogP of 12.82, 20 rotatable bonds, 14 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methylbenzamide;N-[5-(5,6-dimethoxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide;1-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-3-phenylurea;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(piperidin-1-ylmethyl)cyclopenta-1,3-diene-1-carboxamide is sourced from PubChem (CID 158839068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).