5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione

C12H14N2O2 — CID 4060

💊View drug profile → mephenytoin
IUPAC5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione
SMILESCCC1(c2ccccc2)NC(=O)N(C)C1=O
InChIInChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)
InChIKeyGMHKMTDVRCWUDX-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.47
Rot. Bonds2

About 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione

5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione (PubChem CID 4060) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione
PubChem CID4060
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione
SMILESCCC1(c2ccccc2)NC(=O)N(C)C1=O
InChIInChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)
InChIKeyGMHKMTDVRCWUDX-UHFFFAOYSA-N
XLogP1.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.47
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

Phenytoin
CID 1775
Ethotoin
CID 3292
Phenytoin Sodium
CID 657302
Fosphenytoin
CID 56339
Fosphenytoin Sodium
CID 56338
Nirvanol
CID 91480
(5S)-5-methyl-5-phenylimidazolidine-2,4-dione
CID 640021
Mephenytoin, (+)-
CID 107921
Phenylhydantoin
CID 1002
3',4'-Dihydrospiro[imidazolidine-4,1'(2'H)-naphthalene]-2,5-dione
CID 99720
5-Phenyl-5-propylimidazolidine-2,4-dione
CID 219572
5,5-Diphenyl-2-thiohydantoin
CID 854150

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione (CID 4060) is 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione is CCC1(c2ccccc2)NC(=O)N(C)C1=O.
What is the InChIKey of 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione?
The InChIKey is GMHKMTDVRCWUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16).
What are the key properties of 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione?
5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione has a molecular weight of 218.26 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 4060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).