2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid

C13H12N4O3 — CID 106373032

About 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid

2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 106373032) has the molecular formula C13H12N4O3 and a molecular weight of 272.26 g/mol. Its IUPAC name is 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

• Compound Name: 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid
• PubChem CID: 106373032
• Molecular Formula: C13H12N4O3
• Molecular Weight: 272.26 g/mol
• Exact Mass: 272.09
• IUPAC Name: 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid
• SMILES: Cc1cnc(CNc2nc3ccccn3c2C(=O)O)o1
• InChI: InChI=1S/C13H12N4O3/c1-8-6-14-10(20-8)7-15-12-11(13(18)19)17-5-3-2-4-9(17)16-12/h2-6,15H,7H2,1H3,(H,18,19)
• InChIKey: AJBVQNYGWHJSRA-UHFFFAOYSA-N
• XLogP: 1.94
• TPSA: 92.66 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	272.26
LogP ≤ 5	1.94
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid?

The IUPAC name of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid (CID 106373032) is 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid.

What is the SMILES notation for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid?

The canonical SMILES for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid is Cc1cnc(CNc2nc3ccccn3c2C(=O)O)o1.

What is the InChIKey of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid?

The InChIKey is AJBVQNYGWHJSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O3/c1-8-6-14-10(20-8)7-15-12-11(13(18)19)17-5-3-2-4-9(17)16-12/h2-6,15H,7H2,1H3,(H,18,19).

What are the key properties of 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid?

2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 272.26 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(5-methyl-1,3-oxazol-2-yl)methylamino]imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 106373032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).