N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide

C20H20N2O3 — CID 53180580

IUPACN-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
SMILESCc1ccc(-c2cn(CC(=O)Nc3cccc(C)c3C)c(=O)o2)cc1
InChIInChI=1S/C20H20N2O3/c1-13-7-9-16(10-8-13)18-11-22(20(24)25-18)12-19(23)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,23)
InChIKeyKETDCDIDXPCOIW-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.67
Rot. Bonds4

About N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide

N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide (PubChem CID 53180580) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
PubChem CID53180580
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide
SMILESCc1ccc(-c2cn(CC(=O)Nc3cccc(C)c3C)c(=O)o2)cc1
InChIInChI=1S/C20H20N2O3/c1-13-7-9-16(10-8-13)18-11-22(20(24)25-18)12-19(23)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,23)
InChIKeyKETDCDIDXPCOIW-UHFFFAOYSA-N
XLogP3.67
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide 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 N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide (CID 53180580) is N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide is Cc1ccc(-c2cn(CC(=O)Nc3cccc(C)c3C)c(=O)o2)cc1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
The InChIKey is KETDCDIDXPCOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-13-7-9-16(10-8-13)18-11-22(20(24)25-18)12-19(23)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,23).
What are the key properties of N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide?
N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide has a molecular weight of 336.39 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[5-(4-methylphenyl)-2-oxo-1,3-oxazol-3-yl]acetamide is sourced from PubChem (CID 53180580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).