4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one

C9H7FN2O — CID 67151781

IUPAC4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one
SMILESO=C1N=C(c2ccc(F)cc2)CN1
InChIInChI=1S/C9H7FN2O/c10-7-3-1-6(2-4-7)8-5-11-9(13)12-8/h1-4H,5H2,(H,11,13)
InChIKeyDBHWVXYRXLNGKF-UHFFFAOYSA-N
MW178.17 g/mol
LogP1.34
Rot. Bonds1

About 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one

4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one (PubChem CID 67151781) has the molecular formula C9H7FN2O and a molecular weight of 178.17 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one
PubChem CID67151781
Molecular FormulaC9H7FN2O
Molecular Weight178.17 g/mol
Exact Mass178.05
IUPAC Name4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one
SMILESO=C1N=C(c2ccc(F)cc2)CN1
InChIInChI=1S/C9H7FN2O/c10-7-3-1-6(2-4-7)8-5-11-9(13)12-8/h1-4H,5H2,(H,11,13)
InChIKeyDBHWVXYRXLNGKF-UHFFFAOYSA-N
XLogP1.34
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.17
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one (CID 67151781) is 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one is O=C1N=C(c2ccc(F)cc2)CN1.
What is the InChIKey of 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one?
The InChIKey is DBHWVXYRXLNGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2O/c10-7-3-1-6(2-4-7)8-5-11-9(13)12-8/h1-4H,5H2,(H,11,13).
What are the key properties of 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one?
4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one has a molecular weight of 178.17 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 67151781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).