5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione

C12H14N2O3 — CID 3028679

IUPAC5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione
SMILESCCOCC1(c2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C12H14N2O3/c1-2-17-8-12(9-6-4-3-5-7-9)10(15)13-11(16)14-12/h3-7H,2,8H2,1H3,(H2,13,14,15,16)
InChIKeyYYJSIIYDKXEEJM-UHFFFAOYSA-N
MW234.25 g/mol
LogP0.76
Rot. Bonds4

About 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione

5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 3028679) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione
PubChem CID3028679
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione
SMILESCCOCC1(c2ccccc2)NC(=O)NC1=O
InChIInChI=1S/C12H14N2O3/c1-2-17-8-12(9-6-4-3-5-7-9)10(15)13-11(16)14-12/h3-7H,2,8H2,1H3,(H2,13,14,15,16)
InChIKeyYYJSIIYDKXEEJM-UHFFFAOYSA-N
XLogP0.76
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 50.76
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-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione (CID 3028679) is 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione is CCOCC1(c2ccccc2)NC(=O)NC1=O.
What is the InChIKey of 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is YYJSIIYDKXEEJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-2-17-8-12(9-6-4-3-5-7-9)10(15)13-11(16)14-12/h3-7H,2,8H2,1H3,(H2,13,14,15,16).
What are the key properties of 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione?
5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 234.25 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethoxymethyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 3028679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).