6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one

C14H14FNO2 — CID 82519671

IUPAC6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one
SMILESCC(C)(O)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C14H14FNO2/c1-14(2,18)11-7-8-12(16-13(11)17)9-3-5-10(15)6-4-9/h3-8,18H,1-2H3,(H,16,17)
InChIKeyZJFABRMVLWRJFW-UHFFFAOYSA-N
MW247.27 g/mol
LogP2.41
Rot. Bonds2

About 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one

6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one (PubChem CID 82519671) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one
PubChem CID82519671
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one
SMILESCC(C)(O)c1ccc(-c2ccc(F)cc2)[nH]c1=O
InChIInChI=1S/C14H14FNO2/c1-14(2,18)11-7-8-12(16-13(11)17)9-3-5-10(15)6-4-9/h3-8,18H,1-2H3,(H,16,17)
InChIKeyZJFABRMVLWRJFW-UHFFFAOYSA-N
XLogP2.41
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-hydroxypropan-2-yl)-6-(4-propan-2-ylphenyl)-1H-pyridin-2-one
CID 82520467
5,7-difluoro-3-[4-(2-hydroxypropan-2-yl)phenyl]-2H-isoquinolin-1-one
CID 73058322
methyl 6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylate
CID 66489830
6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1-methylpyridin-2-one
CID 82519641
6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carbaldehyde
CID 82519690
ethyl 6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxylate
CID 66490237
6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1-propan-2-ylpyridin-2-one
CID 82519583
2-ethyl-6-(4-fluorophenyl)-4-(2-hydroxypropan-2-yl)pyridazin-3-one
CID 82444919
6-(4-fluorophenyl)-N-(2-methylpropyl)-2-oxo-1H-pyridine-3-carboxamide
CID 125491162
[5-fluoro-2-(2-hydroxypropan-2-yl)phenyl]boronic acid
CID 55265948
N-(5-chloro-2-methylphenyl)-6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 66497756
2-(4-fluorophenyl)propan-2-ol
CID 637733

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one?
The IUPAC name of 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one (CID 82519671) is 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one is CC(C)(O)c1ccc(-c2ccc(F)cc2)[nH]c1=O.
What is the InChIKey of 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one?
The InChIKey is ZJFABRMVLWRJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO2/c1-14(2,18)11-7-8-12(16-13(11)17)9-3-5-10(15)6-4-9/h3-8,18H,1-2H3,(H,16,17).
What are the key properties of 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one?
6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one has a molecular weight of 247.27 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-3-(2-hydroxypropan-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 82519671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).