4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid

C11H8N4O3 — CID 82373652

IUPAC4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid
SMILESCc1noc(C(=O)O)c1-c1cnc2ncccn12
InChIInChI=1S/C11H8N4O3/c1-6-8(9(10(16)17)18-14-6)7-5-13-11-12-3-2-4-15(7)11/h2-5H,1H3,(H,16,17)
InChIKeyMAIGXKOWAOJWDG-UHFFFAOYSA-N
MW244.21 g/mol
LogP1.39
Rot. Bonds2

About 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid

4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid (PubChem CID 82373652) has the molecular formula C11H8N4O3 and a molecular weight of 244.21 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid
PubChem CID82373652
Molecular FormulaC11H8N4O3
Molecular Weight244.21 g/mol
Exact Mass244.06
IUPAC Name4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid
SMILESCc1noc(C(=O)O)c1-c1cnc2ncccn12
InChIInChI=1S/C11H8N4O3/c1-6-8(9(10(16)17)18-14-6)7-5-13-11-12-3-2-4-15(7)11/h2-5H,1H3,(H,16,17)
InChIKeyMAIGXKOWAOJWDG-UHFFFAOYSA-N
XLogP1.39
TPSA93.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The IUPAC name of 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid (CID 82373652) is 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid.
What is the SMILES notation for 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The canonical SMILES for 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid is Cc1noc(C(=O)O)c1-c1cnc2ncccn12.
What is the InChIKey of 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
The InChIKey is MAIGXKOWAOJWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O3/c1-6-8(9(10(16)17)18-14-6)7-5-13-11-12-3-2-4-15(7)11/h2-5H,1H3,(H,16,17).
What are the key properties of 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid?
4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid has a molecular weight of 244.21 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyrimidin-3-yl-3-methyl-1,2-oxazole-5-carboxylic acid is sourced from PubChem (CID 82373652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).