5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide

C18H16N2O2 — CID 651124

IUPAC5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccccc2)noc1C
InChIInChI=1S/C18H16N2O2/c1-12-8-6-7-11-15(12)19-18(21)16-13(2)22-20-17(16)14-9-4-3-5-10-14/h3-11H,1-2H3,(H,19,21)
InChIKeyLPKXOPXPIBAIHN-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.21
Rot. Bonds3

About 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide

5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 651124) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
PubChem CID651124
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccccc2)noc1C
InChIInChI=1S/C18H16N2O2/c1-12-8-6-7-11-15(12)19-18(21)16-13(2)22-20-17(16)14-9-4-3-5-10-14/h3-11H,1-2H3,(H,19,21)
InChIKeyLPKXOPXPIBAIHN-UHFFFAOYSA-N
XLogP4.21
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide 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 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide (CID 651124) is 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide is Cc1ccccc1NC(=O)c1c(-c2ccccc2)noc1C.
What is the InChIKey of 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is LPKXOPXPIBAIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-8-6-7-11-15(12)19-18(21)16-13(2)22-20-17(16)14-9-4-3-5-10-14/h3-11H,1-2H3,(H,19,21).
What are the key properties of 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methylphenyl)-3-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 651124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).