N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide

C24H28N4O2 — CID 171564415

About N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide

N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide (PubChem CID 171564415) has the molecular formula C24H28N4O2 and a molecular weight of 404.51 g/mol. Its IUPAC name is N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide.

Molecular Properties

• Compound Name: N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide
• PubChem CID: 171564415
• Molecular Formula: C24H28N4O2
• Molecular Weight: 404.51 g/mol
• Exact Mass: 404.22
• IUPAC Name: N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide
• SMILES: COc1ccc(-c2cccn3c(C(C)(C)NC(=O)C4C5CNCC4C5)ncc23)cc1
• InChI: InChI=1S/C24H28N4O2/c1-24(2,27-22(29)21-16-11-17(21)13-25-12-16)23-26-14-20-19(5-4-10-28(20)23)15-6-8-18(30-3)9-7-15/h4-10,14,16-17,21,25H,11-13H2,1-3H3,(H,27,29)
• InChIKey: OAOUXCHAFUVRPM-UHFFFAOYSA-N
• XLogP: 3.22
• TPSA: 67.66 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	404.51
LogP ≤ 5	3.22
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide?

The IUPAC name of N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide (CID 171564415) is N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide.

What is the SMILES notation for N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide?

The canonical SMILES for N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide is COc1ccc(-c2cccn3c(C(C)(C)NC(=O)C4C5CNCC4C5)ncc23)cc1.

What is the InChIKey of N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide?

The InChIKey is OAOUXCHAFUVRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O2/c1-24(2,27-22(29)21-16-11-17(21)13-25-12-16)23-26-14-20-19(5-4-10-28(20)23)15-6-8-18(30-3)9-7-15/h4-10,14,16-17,21,25H,11-13H2,1-3H3,(H,27,29).

What are the key properties of N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide?

N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide has a molecular weight of 404.51 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[8-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.1]heptane-6-carboxamide is sourced from PubChem (CID 171564415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).