3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide

C22H22N4O3 — CID 110608016

About 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide

3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 110608016) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

• Compound Name: 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide
• PubChem CID: 110608016
• Molecular Formula: C22H22N4O3
• Molecular Weight: 390.44 g/mol
• Exact Mass: 390.17
• IUPAC Name: 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide
• SMILES: Cn1c(=O)oc2ccc(NC(=O)c3nc(C4CCCCC4)n4ccccc34)cc21
• InChI: InChI=1S/C22H22N4O3/c1-25-17-13-15(10-11-18(17)29-22(25)28)23-21(27)19-16-9-5-6-12-26(16)20(24-19)14-7-3-2-4-8-14/h5-6,9-14H,2-4,7-8H2,1H3,(H,23,27)
• InChIKey: QESXACZYQOPYRC-UHFFFAOYSA-N
• XLogP: 4.08
• TPSA: 81.54 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	390.44
LogP ≤ 5	4.08
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide?

The IUPAC name of 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide (CID 110608016) is 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide.

What is the SMILES notation for 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide?

The canonical SMILES for 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide is Cn1c(=O)oc2ccc(NC(=O)c3nc(C4CCCCC4)n4ccccc34)cc21.

What is the InChIKey of 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide?

The InChIKey is QESXACZYQOPYRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-25-17-13-15(10-11-18(17)29-22(25)28)23-21(27)19-16-9-5-6-12-26(16)20(24-19)14-7-3-2-4-8-14/h5-6,9-14H,2-4,7-8H2,1H3,(H,23,27).

What are the key properties of 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide?

3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 390.44 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-cyclohexyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 110608016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).