3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione

C13H16N2O3 — CID 62819757

IUPAC3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione
SMILESCOc1ccccc1N1C(=O)N(C)C(C)(C)C1=O
InChIInChI=1S/C13H16N2O3/c1-13(2)11(16)15(12(17)14(13)3)9-7-5-6-8-10(9)18-4/h5-8H,1-4H3
InChIKeyGATJUFUYVWODTA-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.87
Rot. Bonds2

About 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione

3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione (PubChem CID 62819757) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione
PubChem CID62819757
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione
SMILESCOc1ccccc1N1C(=O)N(C)C(C)(C)C1=O
InChIInChI=1S/C13H16N2O3/c1-13(2)11(16)15(12(17)14(13)3)9-7-5-6-8-10(9)18-4/h5-8H,1-4H3
InChIKeyGATJUFUYVWODTA-UHFFFAOYSA-N
XLogP1.87
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.87
H-Bond Donors ≤ 50
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-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione (CID 62819757) is 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione is COc1ccccc1N1C(=O)N(C)C(C)(C)C1=O.
What is the InChIKey of 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione?
The InChIKey is GATJUFUYVWODTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-13(2)11(16)15(12(17)14(13)3)9-7-5-6-8-10(9)18-4/h5-8H,1-4H3.
What are the key properties of 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione?
3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione has a molecular weight of 248.28 g/mol, XLogP of 1.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1,5,5-trimethylimidazolidine-2,4-dione is sourced from PubChem (CID 62819757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).