4-(2-fluorophenyl)imidazol-2-one

C9H5FN2O — CID 57279310

IUPAC4-(2-fluorophenyl)imidazol-2-one
SMILESO=C1N=CC(c2ccccc2F)=N1
InChIInChI=1S/C9H5FN2O/c10-7-4-2-1-3-6(7)8-5-11-9(13)12-8/h1-5H
InChIKeyHUQGUBYYSJATQS-UHFFFAOYSA-N
MW176.15 g/mol
LogP1.82
Rot. Bonds1

About 4-(2-fluorophenyl)imidazol-2-one

4-(2-fluorophenyl)imidazol-2-one (PubChem CID 57279310) has the molecular formula C9H5FN2O and a molecular weight of 176.15 g/mol. Its IUPAC name is 4-(2-fluorophenyl)imidazol-2-one.

Molecular Properties

Compound Name4-(2-fluorophenyl)imidazol-2-one
PubChem CID57279310
Molecular FormulaC9H5FN2O
Molecular Weight176.15 g/mol
Exact Mass176.04
IUPAC Name4-(2-fluorophenyl)imidazol-2-one
SMILESO=C1N=CC(c2ccccc2F)=N1
InChIInChI=1S/C9H5FN2O/c10-7-4-2-1-3-6(7)8-5-11-9(13)12-8/h1-5H
InChIKeyHUQGUBYYSJATQS-UHFFFAOYSA-N
XLogP1.82
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.15
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)imidazol-2-one?
The IUPAC name of 4-(2-fluorophenyl)imidazol-2-one (CID 57279310) is 4-(2-fluorophenyl)imidazol-2-one.
What is the SMILES notation for 4-(2-fluorophenyl)imidazol-2-one?
The canonical SMILES for 4-(2-fluorophenyl)imidazol-2-one is O=C1N=CC(c2ccccc2F)=N1.
What is the InChIKey of 4-(2-fluorophenyl)imidazol-2-one?
The InChIKey is HUQGUBYYSJATQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5FN2O/c10-7-4-2-1-3-6(7)8-5-11-9(13)12-8/h1-5H.
What are the key properties of 4-(2-fluorophenyl)imidazol-2-one?
4-(2-fluorophenyl)imidazol-2-one has a molecular weight of 176.15 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)imidazol-2-one is sourced from PubChem (CID 57279310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).