3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione

C12H12N2O3 — CID 154168630

IUPAC3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione
SMILESCC(=O)N1C(=O)CN(c2ccccc2C)C1=O
InChIInChI=1S/C12H12N2O3/c1-8-5-3-4-6-10(8)13-7-11(16)14(9(2)15)12(13)17/h3-6H,7H2,1-2H3
InChIKeyOTJJLOSLPBFLQX-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.31
Rot. Bonds1

About 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione

3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione (PubChem CID 154168630) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione
PubChem CID154168630
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Name3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione
SMILESCC(=O)N1C(=O)CN(c2ccccc2C)C1=O
InChIInChI=1S/C12H12N2O3/c1-8-5-3-4-6-10(8)13-7-11(16)14(9(2)15)12(13)17/h3-6H,7H2,1-2H3
InChIKeyOTJJLOSLPBFLQX-UHFFFAOYSA-N
XLogP1.31
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione with MolForge

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

Launch Full Analysis

Related Compounds

3-acetyl-1-(2-methylphenyl)pyrrolidine-2,4-dione
CID 67764530
1-(2-methylphenyl)-4-phenylpiperazin-2-one
CID 91159394
1-(2-methylphenyl)-4-(6-oxo-1H-pyridine-3-carbonyl)piperazin-2-one
CID 70741081
(2S)-1-(2-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 171323293
azane;3-(2-methylphenyl)-2H-1,3-thiazole-4-carboxamide
CID 174787202
4-(2-methylphenyl)-1,4-diazepan-5-one
CID 45096923
(1R,2S,6R,7R)-4-(2-methylphenyl)-4-azatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione
CID 18554840
1-(2-methylphenyl)-4-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 17080667
3-methyl-1-(2-methylphenyl)-4-(2-methylpropanoyl)piperazin-2-one
CID 24715884
(3S)-N-(4-acetamidophenyl)-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 1090575
3-(2-methylphenyl)-2-oxo-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
CID 115009778
4-[4-(diethylamino)benzoyl]-1-(2-methylphenyl)piperazin-2-one
CID 70715907

Frequently Asked Questions

What is the IUPAC name of 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione (CID 154168630) is 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione is CC(=O)N1C(=O)CN(c2ccccc2C)C1=O.
What is the InChIKey of 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is OTJJLOSLPBFLQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-8-5-3-4-6-10(8)13-7-11(16)14(9(2)15)12(13)17/h3-6H,7H2,1-2H3.
What are the key properties of 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione?
3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 232.24 g/mol, XLogP of 1.31, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetyl-1-(2-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 154168630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).