N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide

C28H30N4O3 — CID 171543958

About N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide

N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide (PubChem CID 171543958) has the molecular formula C28H30N4O3 and a molecular weight of 470.57 g/mol. Its IUPAC name is N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide.

Molecular Properties

• Compound Name: N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide
• PubChem CID: 171543958
• Molecular Formula: C28H30N4O3
• Molecular Weight: 470.57 g/mol
• Exact Mass: 470.23
• IUPAC Name: N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide
• SMILES: COc1cccc(-c2nc(C3CCCN(C(=O)Nc4cccc(OC)c4C)C3)n3ccccc23)c1
• InChI: InChI=1S/C28H30N4O3/c1-19-23(12-7-14-25(19)35-3)29-28(33)31-15-8-10-21(18-31)27-30-26(24-13-4-5-16-32(24)27)20-9-6-11-22(17-20)34-2/h4-7,9,11-14,16-17,21H,8,10,15,18H2,1-3H3,(H,29,33)
• InChIKey: DDWWMPXHQGKANR-UHFFFAOYSA-N
• XLogP: 5.74
• TPSA: 68.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	470.57
LogP ≤ 5	5.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide?

The IUPAC name of N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide (CID 171543958) is N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide.

What is the SMILES notation for N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide?

The canonical SMILES for N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide is COc1cccc(-c2nc(C3CCCN(C(=O)Nc4cccc(OC)c4C)C3)n3ccccc23)c1.

What is the InChIKey of N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide?

The InChIKey is DDWWMPXHQGKANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N4O3/c1-19-23(12-7-14-25(19)35-3)29-28(33)31-15-8-10-21(18-31)27-30-26(24-13-4-5-16-32(24)27)20-9-6-11-22(17-20)34-2/h4-7,9,11-14,16-17,21H,8,10,15,18H2,1-3H3,(H,29,33).

What are the key properties of N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide?

N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide has a molecular weight of 470.57 g/mol, XLogP of 5.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-methoxy-2-methylphenyl)-3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]piperidine-1-carboxamide is sourced from PubChem (CID 171543958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).