3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C20H16FN5O3 — CID 109070511

About 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109070511) has the molecular formula C20H16FN5O3 and a molecular weight of 393.38 g/mol. Its IUPAC name is 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

• Compound Name: 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
• PubChem CID: 109070511
• Molecular Formula: C20H16FN5O3
• Molecular Weight: 393.38 g/mol
• Exact Mass: 393.12
• IUPAC Name: 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
• SMILES: Cc1cc(NC(=O)c2nc(C(=O)NCc3ccc(F)cc3)n3ccccc23)no1
• InChI: InChI=1S/C20H16FN5O3/c1-12-10-16(25-29-12)23-19(27)17-15-4-2-3-9-26(15)18(24-17)20(28)22-11-13-5-7-14(21)8-6-13/h2-10H,11H2,1H3,(H,22,28)(H,23,25,27)
• InChIKey: HDOCQQJKGMPFMM-UHFFFAOYSA-N
• XLogP: 2.95
• TPSA: 101.53 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	393.38
LogP ≤ 5	2.95
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?

The IUPAC name of 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109070511) is 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

What is the SMILES notation for 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?

The canonical SMILES for 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is Cc1cc(NC(=O)c2nc(C(=O)NCc3ccc(F)cc3)n3ccccc23)no1.

What is the InChIKey of 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?

The InChIKey is HDOCQQJKGMPFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5O3/c1-12-10-16(25-29-12)23-19(27)17-15-4-2-3-9-26(15)18(24-17)20(28)22-11-13-5-7-14(21)8-6-13/h2-10H,11H2,1H3,(H,22,28)(H,23,25,27).

What are the key properties of 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?

3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 393.38 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-N-[(4-fluorophenyl)methyl]-1-N-(5-methyl-1,2-oxazol-3-yl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109070511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).