4-methyl-5-phenyl-1,3-oxazole

C10H9NO — CID 594392

IUPAC4-methyl-5-phenyl-1,3-oxazole
SMILESCc1ncoc1-c1ccccc1
InChIInChI=1S/C10H9NO/c1-8-10(12-7-11-8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKeyAZNMFVGFAFVVDA-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.65
Rot. Bonds1

About 4-methyl-5-phenyl-1,3-oxazole

4-methyl-5-phenyl-1,3-oxazole (PubChem CID 594392) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 4-methyl-5-phenyl-1,3-oxazole.

Molecular Properties

Compound Name4-methyl-5-phenyl-1,3-oxazole
PubChem CID594392
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name4-methyl-5-phenyl-1,3-oxazole
SMILESCc1ncoc1-c1ccccc1
InChIInChI=1S/C10H9NO/c1-8-10(12-7-11-8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKeyAZNMFVGFAFVVDA-UHFFFAOYSA-N
XLogP2.65
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-methyl-5-phenyl-1,3-oxazole 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-methyl-5-phenyl-1,3-oxazole?
The IUPAC name of 4-methyl-5-phenyl-1,3-oxazole (CID 594392) is 4-methyl-5-phenyl-1,3-oxazole.
What is the SMILES notation for 4-methyl-5-phenyl-1,3-oxazole?
The canonical SMILES for 4-methyl-5-phenyl-1,3-oxazole is Cc1ncoc1-c1ccccc1.
What is the InChIKey of 4-methyl-5-phenyl-1,3-oxazole?
The InChIKey is AZNMFVGFAFVVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c1-8-10(12-7-11-8)9-5-3-2-4-6-9/h2-7H,1H3.
What are the key properties of 4-methyl-5-phenyl-1,3-oxazole?
4-methyl-5-phenyl-1,3-oxazole has a molecular weight of 159.19 g/mol, XLogP of 2.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-phenyl-1,3-oxazole is sourced from PubChem (CID 594392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).