N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide

C25H24FN5O — CID 131673537

About N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide

N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 131673537) has the molecular formula C25H24FN5O and a molecular weight of 429.50 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide
• PubChem CID: 131673537
• Molecular Formula: C25H24FN5O
• Molecular Weight: 429.50 g/mol
• Exact Mass: 429.20
• IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide
• SMILES: O=C(NCc1ccc(F)cc1)c1nc(C2CCCN2Cc2ccccn2)n2ccccc12
• InChI: InChI=1S/C25H24FN5O/c26-19-11-9-18(10-12-19)16-28-25(32)23-21-7-2-4-15-31(21)24(29-23)22-8-5-14-30(22)17-20-6-1-3-13-27-20/h1-4,6-7,9-13,15,22H,5,8,14,16-17H2,(H,28,32)
• InChIKey: ZQENUTUSQFZNLX-UHFFFAOYSA-N
• XLogP: 4.14
• TPSA: 62.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	429.50
LogP ≤ 5	4.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide?

The IUPAC name of N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide (CID 131673537) is N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide.

What is the SMILES notation for N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide?

The canonical SMILES for N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide is O=C(NCc1ccc(F)cc1)c1nc(C2CCCN2Cc2ccccn2)n2ccccc12.

What is the InChIKey of N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide?

The InChIKey is ZQENUTUSQFZNLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN5O/c26-19-11-9-18(10-12-19)16-28-25(32)23-21-7-2-4-15-31(21)24(29-23)22-8-5-14-30(22)17-20-6-1-3-13-27-20/h1-4,6-7,9-13,15,22H,5,8,14,16-17H2,(H,28,32).

What are the key properties of N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide?

N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 429.50 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(4-fluorophenyl)methyl]-3-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 131673537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).