N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide

C25H21N7O — CID 58345275

About N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide

N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide (PubChem CID 58345275) has the molecular formula C25H21N7O and a molecular weight of 435.49 g/mol. Its IUPAC name is N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide
• PubChem CID: 58345275
• Molecular Formula: C25H21N7O
• Molecular Weight: 435.49 g/mol
• Exact Mass: 435.18
• IUPAC Name: N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide
• SMILES: Cc1cnc2c(c1)nc(-c1cccnc1N)n2-c1ccc(CNC(=O)c2cccnc2)cc1
• InChI: InChI=1S/C25H21N7O/c1-16-12-21-24(29-13-16)32(23(31-21)20-5-3-11-28-22(20)26)19-8-6-17(7-9-19)14-30-25(33)18-4-2-10-27-15-18/h2-13,15H,14H2,1H3,(H2,26,28)(H,30,33)
• InChIKey: FLTFZWVWUGGNJJ-UHFFFAOYSA-N
• XLogP: 3.70
• TPSA: 111.61 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	435.49
LogP ≤ 5	3.70
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide?

The IUPAC name of N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide (CID 58345275) is N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide.

What is the SMILES notation for N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide?

The canonical SMILES for N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide is Cc1cnc2c(c1)nc(-c1cccnc1N)n2-c1ccc(CNC(=O)c2cccnc2)cc1.

What is the InChIKey of N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide?

The InChIKey is FLTFZWVWUGGNJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N7O/c1-16-12-21-24(29-13-16)32(23(31-21)20-5-3-11-28-22(20)26)19-8-6-17(7-9-19)14-30-25(33)18-4-2-10-27-15-18/h2-13,15H,14H2,1H3,(H2,26,28)(H,30,33).

What are the key properties of N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide?

N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide has a molecular weight of 435.49 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[4-[2-(2-amino-3-pyridinyl)-6-methylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 58345275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).