N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide

C22H28N4O2 — CID 110621614

About N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 110621614) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
• PubChem CID: 110621614
• Molecular Formula: C22H28N4O2
• Molecular Weight: 380.49 g/mol
• Exact Mass: 380.22
• IUPAC Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide
• SMILES: CC(C)Cc1nc(C(=O)NCC(c2ccco2)N2CCCC2)c2ccccn12
• InChI: InChI=1S/C22H28N4O2/c1-16(2)14-20-24-21(17-8-3-4-12-26(17)20)22(27)23-15-18(19-9-7-13-28-19)25-10-5-6-11-25/h3-4,7-9,12-13,16,18H,5-6,10-11,14-15H2,1-2H3,(H,23,27)
• InChIKey: ZGAOWGUYMHBJKO-UHFFFAOYSA-N
• XLogP: 3.69
• TPSA: 62.78 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.49
LogP ≤ 5	3.69
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?

The IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 110621614) is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide.

What is the SMILES notation for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?

The canonical SMILES for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide is CC(C)Cc1nc(C(=O)NCC(c2ccco2)N2CCCC2)c2ccccn12.

What is the InChIKey of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?

The InChIKey is ZGAOWGUYMHBJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c1-16(2)14-20-24-21(17-8-3-4-12-26(17)20)22(27)23-15-18(19-9-7-13-28-19)25-10-5-6-11-25/h3-4,7-9,12-13,16,18H,5-6,10-11,14-15H2,1-2H3,(H,23,27).

What are the key properties of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide?

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(2-methylpropyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 110621614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).