5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione

C13H16N2O3 — CID 3021921

IUPAC5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione
SMILESCCC1(c2ccccc2)NC(=O)N(CCO)C1=O
InChIInChI=1S/C13H16N2O3/c1-2-13(10-6-4-3-5-7-10)11(17)15(8-9-16)12(18)14-13/h3-7,16H,2,8-9H2,1H3,(H,14,18)
InChIKeyVMEIJWDEPHUHMS-UHFFFAOYSA-N
MW248.28 g/mol
LogP0.84
Rot. Bonds4

About 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione

5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 3021921) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione
PubChem CID3021921
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione
SMILESCCC1(c2ccccc2)NC(=O)N(CCO)C1=O
InChIInChI=1S/C13H16N2O3/c1-2-13(10-6-4-3-5-7-10)11(17)15(8-9-16)12(18)14-13/h3-7,16H,2,8-9H2,1H3,(H,14,18)
InChIKeyVMEIJWDEPHUHMS-UHFFFAOYSA-N
XLogP0.84
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione (CID 3021921) is 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione is CCC1(c2ccccc2)NC(=O)N(CCO)C1=O.
What is the InChIKey of 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is VMEIJWDEPHUHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-2-13(10-6-4-3-5-7-10)11(17)15(8-9-16)12(18)14-13/h3-7,16H,2,8-9H2,1H3,(H,14,18).
What are the key properties of 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione?
5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 248.28 g/mol, XLogP of 0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-hydroxyethyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 3021921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).