[4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol

C26H22N6O — CID 171495649

About [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol

[4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol (PubChem CID 171495649) has the molecular formula C26H22N6O and a molecular weight of 434.50 g/mol. Its IUPAC name is [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol.

Molecular Properties

• Compound Name: [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol
• PubChem CID: 171495649
• Molecular Formula: C26H22N6O
• Molecular Weight: 434.50 g/mol
• Exact Mass: 434.19
• IUPAC Name: [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol
• SMILES: Nc1ncccc1-c1nc2ccc(-c3ccc(C4CC4)cn3)nc2n1-c1ccc(CO)cc1
• InChI: InChI=1S/C26H22N6O/c27-24-20(2-1-13-28-24)25-31-23-12-11-22(21-10-7-18(14-29-21)17-5-6-17)30-26(23)32(25)19-8-3-16(15-33)4-9-19/h1-4,7-14,17,33H,5-6,15H2,(H2,27,28)
• InChIKey: RZZHPPNWPHZRKA-UHFFFAOYSA-N
• XLogP: 4.50
• TPSA: 102.74 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	434.50
LogP ≤ 5	4.50
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol?

The IUPAC name of [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol (CID 171495649) is [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol.

What is the SMILES notation for [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol?

The canonical SMILES for [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol is Nc1ncccc1-c1nc2ccc(-c3ccc(C4CC4)cn3)nc2n1-c1ccc(CO)cc1.

What is the InChIKey of [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol?

The InChIKey is RZZHPPNWPHZRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N6O/c27-24-20(2-1-13-28-24)25-31-23-12-11-22(21-10-7-18(14-29-21)17-5-6-17)30-26(23)32(25)19-8-3-16(15-33)4-9-19/h1-4,7-14,17,33H,5-6,15H2,(H2,27,28).

What are the key properties of [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol?

[4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol has a molecular weight of 434.50 g/mol, XLogP of 4.50, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[2-(2-amino-3-pyridinyl)-5-(5-cyclopropyl-2-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]methanol is sourced from PubChem (CID 171495649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).