5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione

C16H18N2O3 — CID 90358668

IUPAC5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione
SMILESCC1(C2CCC2)NC(=O)N(CC(=O)c2ccccc2)C1=O
InChIInChI=1S/C16H18N2O3/c1-16(12-8-5-9-12)14(20)18(15(21)17-16)10-13(19)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,17,21)
InChIKeyICJVSUIWWFPCHI-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.98
Rot. Bonds4

About 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione

5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione (PubChem CID 90358668) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione
PubChem CID90358668
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione
SMILESCC1(C2CCC2)NC(=O)N(CC(=O)c2ccccc2)C1=O
InChIInChI=1S/C16H18N2O3/c1-16(12-8-5-9-12)14(20)18(15(21)17-16)10-13(19)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,17,21)
InChIKeyICJVSUIWWFPCHI-UHFFFAOYSA-N
XLogP1.98
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-methyl-5-(3-methylcyclohexyl)-3-phenacylimidazolidine-2,4-dione
CID 90358274
5-cyclobutyl-1,5-dimethyl-3-phenacylimidazolidine-2,4-dione
CID 78324504
5-[(1S,2S,4S)-2-bicyclo[2.2.2]oct-5-enyl]-5-methyl-3-phenacylimidazolidine-2,4-dione
CID 118599504
(5R)-5-cyclopropyl-5-methyl-3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]imidazolidine-2,4-dione
CID 25485121
5-cyclopropyl-5-methyl-3-[2-oxo-2-(2-phenylpyrrolidin-1-yl)ethyl]imidazolidine-2,4-dione
CID 56809766
(5R)-3-[2-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]-5-cyclohexyl-5-methylimidazolidine-2,4-dione
CID 7618955
5-cyclopropyl-5-methyl-3-[2-oxo-2-[2-(2-phenylethyl)pyrrolidin-1-yl]ethyl]imidazolidine-2,4-dione
CID 87025737
N-benzyl-2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-phenylacetamide
CID 78790776
3-[2-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione
CID 84601822
N-(2-benzylphenyl)-2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 16556819
N-[4-[[2-[(4R)-4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-2,5-dimethoxyphenyl]benzamide
CID 41208294
3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione
CID 24542027

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione?
The IUPAC name of 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione (CID 90358668) is 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione.
What is the SMILES notation for 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione?
The canonical SMILES for 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione is CC1(C2CCC2)NC(=O)N(CC(=O)c2ccccc2)C1=O.
What is the InChIKey of 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione?
The InChIKey is ICJVSUIWWFPCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-16(12-8-5-9-12)14(20)18(15(21)17-16)10-13(19)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,17,21).
What are the key properties of 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione?
5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione has a molecular weight of 286.33 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-5-methyl-3-phenacylimidazolidine-2,4-dione is sourced from PubChem (CID 90358668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).