3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine

C23H20FN7 — CID 136937556

About 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine

3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine (PubChem CID 136937556) has the molecular formula C23H20FN7 and a molecular weight of 413.46 g/mol. Its IUPAC name is 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

• Compound Name: 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
• PubChem CID: 136937556
• Molecular Formula: C23H20FN7
• Molecular Weight: 413.46 g/mol
• Exact Mass: 413.18
• IUPAC Name: 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine
• SMILES: Fc1ccc(-c2ccnc3nc(-c4n[nH]c5cnc(C6CCNCC6)cc45)[nH]c23)cc1
• InChI: InChI=1S/C23H20FN7/c24-15-3-1-13(2-4-15)16-7-10-26-22-20(16)28-23(29-22)21-17-11-18(14-5-8-25-9-6-14)27-12-19(17)30-31-21/h1-4,7,10-12,14,25H,5-6,8-9H2,(H,30,31)(H,26,28,29)
• InChIKey: GZBVRIVEWOYOEP-UHFFFAOYSA-N
• XLogP: 4.17
• TPSA: 95.17 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	413.46
LogP ≤ 5	4.17
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine?

The IUPAC name of 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine (CID 136937556) is 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine.

What is the SMILES notation for 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine?

The canonical SMILES for 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine is Fc1ccc(-c2ccnc3nc(-c4n[nH]c5cnc(C6CCNCC6)cc45)[nH]c23)cc1.

What is the InChIKey of 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine?

The InChIKey is GZBVRIVEWOYOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN7/c24-15-3-1-13(2-4-15)16-7-10-26-22-20(16)28-23(29-22)21-17-11-18(14-5-8-25-9-6-14)27-12-19(17)30-31-21/h1-4,7,10-12,14,25H,5-6,8-9H2,(H,30,31)(H,26,28,29).

What are the key properties of 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine?

3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 413.46 g/mol, XLogP of 4.17, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-piperidin-4-yl-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 136937556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).