5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine

C22H14N8 — CID 137112641

About 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine

5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine (PubChem CID 137112641) has the molecular formula C22H14N8 and a molecular weight of 390.41 g/mol. Its IUPAC name is 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine.

Molecular Properties

• Compound Name: 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
• PubChem CID: 137112641
• Molecular Formula: C22H14N8
• Molecular Weight: 390.41 g/mol
• Exact Mass: 390.13
• IUPAC Name: 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
• SMILES: c1ccc(-c2cncc3[nH]c(-c4n[nH]c5ccc(-c6cnccn6)nc45)cc23)nc1
• InChI: InChI=1S/C22H14N8/c1-2-6-25-15(3-1)14-10-24-11-19-13(14)9-18(27-19)22-21-17(29-30-22)5-4-16(28-21)20-12-23-7-8-26-20/h1-12,27H,(H,29,30)
• InChIKey: WIIZDAUIIUYJQN-UHFFFAOYSA-N
• XLogP: 4.02
• TPSA: 108.92 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	390.41
LogP ≤ 5	4.02
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine?

The IUPAC name of 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine (CID 137112641) is 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine.

What is the SMILES notation for 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine?

The canonical SMILES for 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine is c1ccc(-c2cncc3[nH]c(-c4n[nH]c5ccc(-c6cnccn6)nc45)cc23)nc1.

What is the InChIKey of 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine?

The InChIKey is WIIZDAUIIUYJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14N8/c1-2-6-25-15(3-1)14-10-24-11-19-13(14)9-18(27-19)22-21-17(29-30-22)5-4-16(28-21)20-12-23-7-8-26-20/h1-12,27H,(H,29,30).

What are the key properties of 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine?

5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine has a molecular weight of 390.41 g/mol, XLogP of 4.02, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-pyrazin-2-yl-3-(4-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 137112641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).