3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one

C10H9FN2O — CID 103126058

IUPAC3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one
SMILESCc1cccc(F)c1-n1cc[nH]c1=O
InChIInChI=1S/C10H9FN2O/c1-7-3-2-4-8(11)9(7)13-6-5-12-10(13)14/h2-6H,1H3,(H,12,14)
InChIKeyHPMSXGPZJSBYFG-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.61
Rot. Bonds1

About 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one

3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one (PubChem CID 103126058) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one.

Molecular Properties

Compound Name3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one
PubChem CID103126058
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one
SMILESCc1cccc(F)c1-n1cc[nH]c1=O
InChIInChI=1S/C10H9FN2O/c1-7-3-2-4-8(11)9(7)13-6-5-12-10(13)14/h2-6H,1H3,(H,12,14)
InChIKeyHPMSXGPZJSBYFG-UHFFFAOYSA-N
XLogP1.61
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one?
The IUPAC name of 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one (CID 103126058) is 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one.
What is the SMILES notation for 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one?
The canonical SMILES for 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one is Cc1cccc(F)c1-n1cc[nH]c1=O.
What is the InChIKey of 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one?
The InChIKey is HPMSXGPZJSBYFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-7-3-2-4-8(11)9(7)13-6-5-12-10(13)14/h2-6H,1H3,(H,12,14).
What are the key properties of 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one?
3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one has a molecular weight of 192.19 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-6-methylphenyl)-1H-imidazol-2-one is sourced from PubChem (CID 103126058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).