1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione

C14H16N2O3 — CID 102155035

IUPAC1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione
SMILESCN1CC(=O)N(C(=O)CCCc2ccccc2)C1=O
InChIInChI=1S/C14H16N2O3/c1-15-10-13(18)16(14(15)19)12(17)9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3
InChIKeyFUSRNHZWGMDFHV-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.43
Rot. Bonds4

About 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione

1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione (PubChem CID 102155035) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione
PubChem CID102155035
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione
SMILESCN1CC(=O)N(C(=O)CCCc2ccccc2)C1=O
InChIInChI=1S/C14H16N2O3/c1-15-10-13(18)16(14(15)19)12(17)9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3
InChIKeyFUSRNHZWGMDFHV-UHFFFAOYSA-N
XLogP1.43
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-methyl-3-(4-phenylbutanoyl)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

5-phenylpentan-2-one
CID 16701
1-(4-phenylbutanoyl)-4-propyl-1,4-diazepan-5-one
CID 26280630
4-phenyl-1-(2,2,4-trimethyl-3H-quinoxalin-1-yl)butan-1-one
CID 167573407
2,2-dimethyl-1-(4-phenylbutanoyl)pyrrolidin-3-one
CID 115275193
1-(4-methylpiperazin-1-yl)-11-phenylundecan-1-one
CID 10545423
1-(4-methylpiperidin-1-yl)-4-phenylbutan-1-one
CID 1122148
1-(4-methylpiperazin-1-yl)-7-phenylheptan-1-one
CID 10827239
1-(3-aminoazetidin-1-yl)-4-phenylbutan-1-one
CID 63753831
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-phenylbutan-1-one
CID 807657
1-[4-(3,3-dimethylbutyl)piperazin-1-yl]-4-phenylbutan-1-one
CID 60539533
2,2-dimethyl-1-(4-phenylbutanoyl)-3H-quinolin-4-one
CID 167644306
N-(2,6-dimethylphenyl)-2-[2-oxo-4-(4-phenylbutanoyl)piperazin-1-yl]acetamide
CID 142161748

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione?
The IUPAC name of 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione (CID 102155035) is 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione is CN1CC(=O)N(C(=O)CCCc2ccccc2)C1=O.
What is the InChIKey of 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione?
The InChIKey is FUSRNHZWGMDFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-15-10-13(18)16(14(15)19)12(17)9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3.
What are the key properties of 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione?
1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione has a molecular weight of 260.29 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(4-phenylbutanoyl)imidazolidine-2,4-dione is sourced from PubChem (CID 102155035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).