2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol

C27H24N4O — CID 140864143

About 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol

2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol (PubChem CID 140864143) has the molecular formula C27H24N4O and a molecular weight of 420.52 g/mol. Its IUPAC name is 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol.

Molecular Properties

• Compound Name: 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol
• PubChem CID: 140864143
• Molecular Formula: C27H24N4O
• Molecular Weight: 420.52 g/mol
• Exact Mass: 420.20
• IUPAC Name: 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol
• SMILES: CC(C)c1cc(-c2ccccn2)cc(-c2ccnc3c2nc(-c2ccccc2O)n3C)c1
• InChI: InChI=1S/C27H24N4O/c1-17(2)18-14-19(16-20(15-18)23-9-6-7-12-28-23)21-11-13-29-27-25(21)30-26(31(27)3)22-8-4-5-10-24(22)32/h4-17,32H,1-3H3
• InChIKey: XRYQYJRDWQJKMJ-UHFFFAOYSA-N
• XLogP: 6.19
• TPSA: 63.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	420.52
LogP ≤ 5	6.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol?

The IUPAC name of 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol (CID 140864143) is 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol.

What is the SMILES notation for 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol?

The canonical SMILES for 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol is CC(C)c1cc(-c2ccccn2)cc(-c2ccnc3c2nc(-c2ccccc2O)n3C)c1.

What is the InChIKey of 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol?

The InChIKey is XRYQYJRDWQJKMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N4O/c1-17(2)18-14-19(16-20(15-18)23-9-6-7-12-28-23)21-11-13-29-27-25(21)30-26(31(27)3)22-8-4-5-10-24(22)32/h4-17,32H,1-3H3.

What are the key properties of 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol?

2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol has a molecular weight of 420.52 g/mol, XLogP of 6.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-methyl-7-(3-propan-2-yl-5-pyridin-2-ylphenyl)imidazo[4,5-b]pyridin-2-yl]phenol is sourced from PubChem (CID 140864143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).