2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide

C23H25N3O — CID 112833184

About 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide

2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide (PubChem CID 112833184) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide.

Molecular Properties

• Compound Name: 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide
• PubChem CID: 112833184
• Molecular Formula: C23H25N3O
• Molecular Weight: 359.47 g/mol
• Exact Mass: 359.20
• IUPAC Name: 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide
• SMILES: CCC(C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1)c1ccccc1
• InChI: InChI=1S/C23H25N3O/c1-2-21(17-8-4-3-5-9-17)23(27)25-19-13-11-18(12-14-19)22-24-16-20-10-6-7-15-26(20)22/h3-5,8-9,11-14,16,21H,2,6-7,10,15H2,1H3,(H,25,27)
• InChIKey: KHDLDTUIQWOLLI-UHFFFAOYSA-N
• XLogP: 5.02
• TPSA: 46.92 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	359.47
LogP ≤ 5	5.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide?

The IUPAC name of 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide (CID 112833184) is 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide.

What is the SMILES notation for 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide?

The canonical SMILES for 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide is CCC(C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1)c1ccccc1.

What is the InChIKey of 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide?

The InChIKey is KHDLDTUIQWOLLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-2-21(17-8-4-3-5-9-17)23(27)25-19-13-11-18(12-14-19)22-24-16-20-10-6-7-15-26(20)22/h3-5,8-9,11-14,16,21H,2,6-7,10,15H2,1H3,(H,25,27).

What are the key properties of 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide?

2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide has a molecular weight of 359.47 g/mol, XLogP of 5.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-phenyl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]butanamide is sourced from PubChem (CID 112833184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).