N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C22H28N4O2 — CID 109074631

About N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109074631) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
• PubChem CID: 109074631
• Molecular Formula: C22H28N4O2
• Molecular Weight: 380.49 g/mol
• Exact Mass: 380.22
• IUPAC Name: N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
• SMILES: O=C(NCCc1ccccc1)c1nc(C(=O)N2CCCCC2)n2c1CCCC2
• InChI: InChI=1S/C22H28N4O2/c27-21(23-13-12-17-9-3-1-4-10-17)19-18-11-5-8-16-26(18)20(24-19)22(28)25-14-6-2-7-15-25/h1,3-4,9-10H,2,5-8,11-16H2,(H,23,27)
• InChIKey: SXBZJTNVALMZKJ-UHFFFAOYSA-N
• XLogP: 2.82
• TPSA: 67.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.49
LogP ≤ 5	2.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The IUPAC name of N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 109074631) is N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

What is the SMILES notation for N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The canonical SMILES for N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is O=C(NCCc1ccccc1)c1nc(C(=O)N2CCCCC2)n2c1CCCC2.

What is the InChIKey of N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

The InChIKey is SXBZJTNVALMZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c27-21(23-13-12-17-9-3-1-4-10-17)19-18-11-5-8-16-26(18)20(24-19)22(28)25-14-6-2-7-15-25/h1,3-4,9-10H,2,5-8,11-16H2,(H,23,27).

What are the key properties of N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?

N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-phenylethyl)-3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109074631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).