3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione

C13H16N2O2 — CID 84571226

IUPAC3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
SMILESCC(C)CN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C13H16N2O2/c1-9(2)8-15-12(16)11(14-13(15)17)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)
InChIKeyYMZRJETYENXQFS-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.94
Rot. Bonds3

About 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione

3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 84571226) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
PubChem CID84571226
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
SMILESCC(C)CN1C(=O)NC(c2ccccc2)C1=O
InChIInChI=1S/C13H16N2O2/c1-9(2)8-15-12(16)11(14-13(15)17)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)
InChIKeyYMZRJETYENXQFS-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-5-phenylimidazolidine-2,4-dione
CID 3292
3-ethyl-5-phenylimidazolidine-2,4-dione;hydrochloride
CID 140541909
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571944
5-phenyl-3-(2-piperidin-1-ylethyl)imidazolidine-2,4-dione
CID 84572821
3-[(2,6-dichlorophenyl)methyl]-5-phenylimidazolidine-2,4-dione
CID 84573203
3-[(4-bromophenyl)methyl]-5-phenylimidazolidine-2,4-dione
CID 84573205
tert-butyl 2-[(4R)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetate
CID 125482450
3-(3-phenoxypropyl)-5-phenylimidazolidine-2,4-dione
CID 84571229
2,3-bis(2-methylpropyl)-5-phenylimidazolidin-4-one
CID 83243088
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide
CID 84571871
6-(2-methylpropyl)-4-phenyl-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione
CID 24712350
2-methyl-3-[4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]propanethioamide
CID 82149111

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione (CID 84571226) is 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione is CC(C)CN1C(=O)NC(c2ccccc2)C1=O.
What is the InChIKey of 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is YMZRJETYENXQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9(2)8-15-12(16)11(14-13(15)17)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17).
What are the key properties of 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione?
3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 232.28 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 84571226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).