3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione

C11H11FN2O3 — CID 81082365

IUPAC3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione
SMILESCOCC1NC(=O)N(c2ccc(F)cc2)C1=O
InChIInChI=1S/C11H11FN2O3/c1-17-6-9-10(15)14(11(16)13-9)8-4-2-7(12)3-5-8/h2-5,9H,6H2,1H3,(H,13,16)
InChIKeyOVIOZQHZYSYQMI-UHFFFAOYSA-N
MW238.22 g/mol
LogP0.90
Rot. Bonds3

About 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione

3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione (PubChem CID 81082365) has the molecular formula C11H11FN2O3 and a molecular weight of 238.22 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione
PubChem CID81082365
Molecular FormulaC11H11FN2O3
Molecular Weight238.22 g/mol
Exact Mass238.08
IUPAC Name3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione
SMILESCOCC1NC(=O)N(c2ccc(F)cc2)C1=O
InChIInChI=1S/C11H11FN2O3/c1-17-6-9-10(15)14(11(16)13-9)8-4-2-7(12)3-5-8/h2-5,9H,6H2,1H3,(H,13,16)
InChIKeyOVIOZQHZYSYQMI-UHFFFAOYSA-N
XLogP0.90
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.22
LogP ≤ 50.90
H-Bond Donors ≤ 51
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 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione (CID 81082365) is 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione is COCC1NC(=O)N(c2ccc(F)cc2)C1=O.
What is the InChIKey of 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione?
The InChIKey is OVIOZQHZYSYQMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O3/c1-17-6-9-10(15)14(11(16)13-9)8-4-2-7(12)3-5-8/h2-5,9H,6H2,1H3,(H,13,16).
What are the key properties of 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione?
3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione has a molecular weight of 238.22 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-5-(methoxymethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 81082365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).