4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one

C12H10FNO — CID 59121139

IUPAC4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one
SMILESCC1=C(c2ccc(F)cc2)C(=O)CN=C1
InChIInChI=1S/C12H10FNO/c1-8-6-14-7-11(15)12(8)9-2-4-10(13)5-3-9/h2-6H,7H2,1H3
InChIKeyQKOJETXSYGHEJP-UHFFFAOYSA-N
MW203.22 g/mol
LogP2.25
Rot. Bonds1

About 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one

4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one (PubChem CID 59121139) has the molecular formula C12H10FNO and a molecular weight of 203.22 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one
PubChem CID59121139
Molecular FormulaC12H10FNO
Molecular Weight203.22 g/mol
Exact Mass203.07
IUPAC Name4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one
SMILESCC1=C(c2ccc(F)cc2)C(=O)CN=C1
InChIInChI=1S/C12H10FNO/c1-8-6-14-7-11(15)12(8)9-2-4-10(13)5-3-9/h2-6H,7H2,1H3
InChIKeyQKOJETXSYGHEJP-UHFFFAOYSA-N
XLogP2.25
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one?
The IUPAC name of 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one (CID 59121139) is 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one.
What is the SMILES notation for 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one?
The canonical SMILES for 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one is CC1=C(c2ccc(F)cc2)C(=O)CN=C1.
What is the InChIKey of 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one?
The InChIKey is QKOJETXSYGHEJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO/c1-8-6-14-7-11(15)12(8)9-2-4-10(13)5-3-9/h2-6H,7H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one?
4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one has a molecular weight of 203.22 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-methyl-2H-pyridin-3-one is sourced from PubChem (CID 59121139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).