N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide

C34H32Cl2FN7O2 — CID 165147584

About N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide

N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide (PubChem CID 165147584) has the molecular formula C34H32Cl2FN7O2 and a molecular weight of 660.58 g/mol. Its IUPAC name is N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
• PubChem CID: 165147584
• Molecular Formula: C34H32Cl2FN7O2
• Molecular Weight: 660.58 g/mol
• Exact Mass: 659.20
• IUPAC Name: N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
• SMILES: COc1nc(-c2cccc(-c3cccc(NC(=O)c4nc5c(n4C)CCN(C)C5)c3Cl)c2Cl)ccc1CNc1ccnc(C)c1F
• InChI: InChI=1S/C34H32Cl2FN7O2/c1-19-31(37)26(13-15-38-19)39-17-20-11-12-24(42-34(20)46-4)23-9-5-7-21(29(23)35)22-8-6-10-25(30(22)36)41-33(45)32-40-27-18-43(2)16-14-28(27)44(32)3/h5-13,15H,14,16-18H2,1-4H3,(H,38,39)(H,41,45)
• InChIKey: BDLFNHWDDPWGLR-UHFFFAOYSA-N
• XLogP: 7.16
• TPSA: 97.20 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	660.58
LogP ≤ 5	7.16
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide?

The IUPAC name of N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide (CID 165147584) is N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide.

What is the SMILES notation for N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide?

The canonical SMILES for N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide is COc1nc(-c2cccc(-c3cccc(NC(=O)c4nc5c(n4C)CCN(C)C5)c3Cl)c2Cl)ccc1CNc1ccnc(C)c1F.

What is the InChIKey of N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide?

The InChIKey is BDLFNHWDDPWGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32Cl2FN7O2/c1-19-31(37)26(13-15-38-19)39-17-20-11-12-24(42-34(20)46-4)23-9-5-7-21(29(23)35)22-8-6-10-25(30(22)36)41-33(45)32-40-27-18-43(2)16-14-28(27)44(32)3/h5-13,15H,14,16-18H2,1-4H3,(H,38,39)(H,41,45).

What are the key properties of N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide?

N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide has a molecular weight of 660.58 g/mol, XLogP of 7.16, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-chloro-3-[2-chloro-3-[5-[[(3-fluoro-2-methyl-4-pyridinyl)amino]methyl]-6-methoxy-2-pyridinyl]phenyl]phenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide is sourced from PubChem (CID 165147584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).