N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

C20H23ClN4O2 — CID 109074103

About N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109074103) has the molecular formula C20H23ClN4O2 and a molecular weight of 386.88 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
• PubChem CID: 109074103
• Molecular Formula: C20H23ClN4O2
• Molecular Weight: 386.88 g/mol
• Exact Mass: 386.15
• IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
• SMILES: O=C(NCc1ccc(Cl)cc1)c1nc(C(=O)N2CCCC2)c2n1CCCC2
• InChI: InChI=1S/C20H23ClN4O2/c21-15-8-6-14(7-9-15)13-22-19(26)18-23-17(16-5-1-2-12-25(16)18)20(27)24-10-3-4-11-24/h6-9H,1-5,10-13H2,(H,22,26)
• InChIKey: GSCJZLAGHXARAQ-UHFFFAOYSA-N
• XLogP: 3.04
• TPSA: 67.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	386.88
LogP ≤ 5	3.04
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The IUPAC name of N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (CID 109074103) is N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The canonical SMILES for N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is O=C(NCc1ccc(Cl)cc1)c1nc(C(=O)N2CCCC2)c2n1CCCC2.

What is the InChIKey of N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The InChIKey is GSCJZLAGHXARAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O2/c21-15-8-6-14(7-9-15)13-22-19(26)18-23-17(16-5-1-2-12-25(16)18)20(27)24-10-3-4-11-24/h6-9H,1-5,10-13H2,(H,22,26).

What are the key properties of N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 386.88 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(4-chlorophenyl)methyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109074103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).