4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine

C24H16FN7 — CID 136937206

About 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine

4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine (PubChem CID 136937206) has the molecular formula C24H16FN7 and a molecular weight of 421.44 g/mol. Its IUPAC name is 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
• PubChem CID: 136937206
• Molecular Formula: C24H16FN7
• Molecular Weight: 421.44 g/mol
• Exact Mass: 421.15
• IUPAC Name: 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
• SMILES: Cc1cc(F)cc(-c2nccc3[nH]c(-c4n[nH]c5ccc(-c6cnccn6)cc45)nc23)c1
• InChI: InChI=1S/C24H16FN7/c1-13-8-15(10-16(25)9-13)21-23-19(4-5-28-21)29-24(30-23)22-17-11-14(2-3-18(17)31-32-22)20-12-26-6-7-27-20/h2-12H,1H3,(H,29,30)(H,31,32)
• InChIKey: SADYYURYVRGVSV-UHFFFAOYSA-N
• XLogP: 5.07
• TPSA: 96.03 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	421.44
LogP ≤ 5	5.07
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?

The IUPAC name of 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine (CID 136937206) is 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine.

What is the SMILES notation for 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?

The canonical SMILES for 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine is Cc1cc(F)cc(-c2nccc3[nH]c(-c4n[nH]c5ccc(-c6cnccn6)cc45)nc23)c1.

What is the InChIKey of 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?

The InChIKey is SADYYURYVRGVSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN7/c1-13-8-15(10-16(25)9-13)21-23-19(4-5-28-21)29-24(30-23)22-17-11-14(2-3-18(17)31-32-22)20-12-26-6-7-27-20/h2-12H,1H3,(H,29,30)(H,31,32).

What are the key properties of 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?

4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine has a molecular weight of 421.44 g/mol, XLogP of 5.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(3-fluoro-5-methylphenyl)-2-(5-pyrazin-2-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 136937206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).