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

C23H15N7 — CID 137111039

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

5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine (PubChem CID 137111039) has the molecular formula C23H15N7 and a molecular weight of 389.42 g/mol. Its IUPAC name is 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

• Compound Name: 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
• PubChem CID: 137111039
• Molecular Formula: C23H15N7
• Molecular Weight: 389.42 g/mol
• Exact Mass: 389.14
• IUPAC Name: 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine
• SMILES: c1ccc(-c2cc3c(-c4cc5c(-c6ccncc6)ccnc5[nH]4)n[nH]c3cn2)nc1
• InChI: InChI=1S/C23H15N7/c1-2-7-25-18(3-1)19-12-17-21(13-27-19)29-30-22(17)20-11-16-15(6-10-26-23(16)28-20)14-4-8-24-9-5-14/h1-13H,(H,26,28)(H,29,30)
• InChIKey: DDHYFISJJLHMQS-UHFFFAOYSA-N
• XLogP: 4.63
• TPSA: 96.03 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.42
LogP ≤ 5	4.63
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine (CID 137111039) is 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine.

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

The canonical SMILES for 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine is c1ccc(-c2cc3c(-c4cc5c(-c6ccncc6)ccnc5[nH]4)n[nH]c3cn2)nc1.

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

The InChIKey is DDHYFISJJLHMQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N7/c1-2-7-25-18(3-1)19-12-17-21(13-27-19)29-30-22(17)20-11-16-15(6-10-26-23(16)28-20)14-4-8-24-9-5-14/h1-13H,(H,26,28)(H,29,30).

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

5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 389.42 g/mol, XLogP of 4.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-pyridin-2-yl-3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 137111039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).