1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione

C18H15FN2O5 — CID 7491794

IUPAC1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione
SMILESCOc1ccc(N2C(=O)C(=O)N(CCOc3ccc(F)cc3)C2=O)cc1
InChIInChI=1S/C18H15FN2O5/c1-25-14-8-4-13(5-9-14)21-17(23)16(22)20(18(21)24)10-11-26-15-6-2-12(19)3-7-15/h2-9H,10-11H2,1H3
InChIKeyODMGIIJUWPDIDP-UHFFFAOYSA-N
MW358.33 g/mol
LogP2.21
Rot. Bonds6

About 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione

1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione (PubChem CID 7491794) has the molecular formula C18H15FN2O5 and a molecular weight of 358.33 g/mol. Its IUPAC name is 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione.

Molecular Properties

Compound Name1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione
PubChem CID7491794
Molecular FormulaC18H15FN2O5
Molecular Weight358.33 g/mol
Exact Mass358.10
IUPAC Name1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione
SMILESCOc1ccc(N2C(=O)C(=O)N(CCOc3ccc(F)cc3)C2=O)cc1
InChIInChI=1S/C18H15FN2O5/c1-25-14-8-4-13(5-9-14)21-17(23)16(22)20(18(21)24)10-11-26-15-6-2-12(19)3-7-15/h2-9H,10-11H2,1H3
InChIKeyODMGIIJUWPDIDP-UHFFFAOYSA-N
XLogP2.21
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.33
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The IUPAC name of 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione (CID 7491794) is 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione.
What is the SMILES notation for 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The canonical SMILES for 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione is COc1ccc(N2C(=O)C(=O)N(CCOc3ccc(F)cc3)C2=O)cc1.
What is the InChIKey of 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
The InChIKey is ODMGIIJUWPDIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O5/c1-25-14-8-4-13(5-9-14)21-17(23)16(22)20(18(21)24)10-11-26-15-6-2-12(19)3-7-15/h2-9H,10-11H2,1H3.
What are the key properties of 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione?
1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione has a molecular weight of 358.33 g/mol, XLogP of 2.21, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenoxy)ethyl]-3-(4-methoxyphenyl)imidazolidine-2,4,5-trione is sourced from PubChem (CID 7491794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).