3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide

C29H30N4O2 — CID 24812517

About 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide

3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide (PubChem CID 24812517) has the molecular formula C29H30N4O2 and a molecular weight of 466.59 g/mol. Its IUPAC name is 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide.

Molecular Properties

• Compound Name: 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide
• PubChem CID: 24812517
• Molecular Formula: C29H30N4O2
• Molecular Weight: 466.59 g/mol
• Exact Mass: 466.24
• IUPAC Name: 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide
• SMILES: COc1cccc(-c2nc(C3CCCN(C(=O)N[C@@H]4C[C@H]4c4ccccc4)C3)n3ccccc23)c1
• InChI: InChI=1S/C29H30N4O2/c1-35-23-13-7-11-21(17-23)27-26-14-5-6-16-33(26)28(31-27)22-12-8-15-32(19-22)29(34)30-25-18-24(25)20-9-3-2-4-10-20/h2-7,9-11,13-14,16-17,22,24-25H,8,12,15,18-19H2,1H3,(H,30,34)/t22?,24-,25+/m0/s1
• InChIKey: OTRPYFHIJZOGLY-OELIULCZSA-N
• XLogP: 5.45
• TPSA: 58.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	466.59
LogP ≤ 5	5.45
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide (CID 24812517) is 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide.

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

The canonical SMILES for 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide is COc1cccc(-c2nc(C3CCCN(C(=O)N[C@@H]4C[C@H]4c4ccccc4)C3)n3ccccc23)c1.

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

The InChIKey is OTRPYFHIJZOGLY-OELIULCZSA-N. The full InChI is InChI=1S/C29H30N4O2/c1-35-23-13-7-11-21(17-23)27-26-14-5-6-16-33(26)28(31-27)22-12-8-15-32(19-22)29(34)30-25-18-24(25)20-9-3-2-4-10-20/h2-7,9-11,13-14,16-17,22,24-25H,8,12,15,18-19H2,1H3,(H,30,34)/t22?,24-,25+/m0/s1.

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

3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide has a molecular weight of 466.59 g/mol, XLogP of 5.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[1-(3-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide is sourced from PubChem (CID 24812517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).