1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one

C12H15FN2O3 — CID 112613063

IUPAC1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCOc1c(F)cccc1CO
InChIInChI=1S/C12H15FN2O3/c13-10-3-1-2-9(8-16)11(10)18-7-6-15-5-4-14-12(15)17/h1-3,16H,4-8H2,(H,14,17)
InChIKeyOGHIJDFJXFLHGE-UHFFFAOYSA-N
MW254.26 g/mol
LogP0.72
Rot. Bonds5

About 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one

1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one (PubChem CID 112613063) has the molecular formula C12H15FN2O3 and a molecular weight of 254.26 g/mol. Its IUPAC name is 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
PubChem CID112613063
Molecular FormulaC12H15FN2O3
Molecular Weight254.26 g/mol
Exact Mass254.11
IUPAC Name1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCOc1c(F)cccc1CO
InChIInChI=1S/C12H15FN2O3/c13-10-3-1-2-9(8-16)11(10)18-7-6-15-5-4-14-12(15)17/h1-3,16H,4-8H2,(H,14,17)
InChIKeyOGHIJDFJXFLHGE-UHFFFAOYSA-N
XLogP0.72
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one (CID 112613063) is 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one is O=C1NCCN1CCOc1c(F)cccc1CO.
What is the InChIKey of 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one?
The InChIKey is OGHIJDFJXFLHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O3/c13-10-3-1-2-9(8-16)11(10)18-7-6-15-5-4-14-12(15)17/h1-3,16H,4-8H2,(H,14,17).
What are the key properties of 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one?
1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one has a molecular weight of 254.26 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-fluoro-6-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 112613063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).