5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one

C14H14FNO — CID 144545564

IUPAC5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
SMILESCCc1cc(C)c(=O)[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C14H14FNO/c1-3-10-8-9(2)14(17)16-13(10)11-4-6-12(15)7-5-11/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyCPEPMYPYWKNIDR-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.05
Rot. Bonds2

About 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one

5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one (PubChem CID 144545564) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
PubChem CID144545564
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
SMILESCCc1cc(C)c(=O)[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C14H14FNO/c1-3-10-8-9(2)14(17)16-13(10)11-4-6-12(15)7-5-11/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyCPEPMYPYWKNIDR-UHFFFAOYSA-N
XLogP3.05
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-[4-(dimethylamino)phenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
CID 144545636
5,6-bis(4-fluorophenyl)-3-methyl-1H-pyridin-2-one
CID 118316459
5-ethyl-3-methyl-6-(1,2,3-trimethylindol-5-yl)-1H-pyridin-2-one
CID 144545870
2-[4-(3-ethyl-5-methyl-6-oxo-1H-pyridin-2-yl)phenyl]-2-azabicyclo[2.2.1]hept-5-en-3-one
CID 144545615
6-(4-aminophenyl)-5-ethyl-2-oxo-1H-pyridine-3-carboxylic acid
CID 89421782
5-ethyl-4-(4-fluorophenyl)-3H-1,3-oxazol-2-one
CID 105459938
6-[4-(dimethylamino)phenyl]-5-ethyl-2-oxo-1H-pyridine-3-carboxylic acid
CID 71282056
5-ethyl-6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 71281958
ethane;1-ethyl-4-fluoro-2-methylbenzene
CID 143471886
5-ethyl-3-methyl-6-(2-piperidin-1-ylphenyl)-1H-pyridin-2-one
CID 144545542
6-[2-(dimethylamino)-4-methoxyphenyl]-5-ethyl-3-methyl-1H-pyridin-2-one
CID 144545602
6-[1-(1,3-dioxolan-2-ylmethyl)indol-5-yl]-5-ethyl-3-methyl-1H-pyridin-2-one
CID 144545794

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one?
The IUPAC name of 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one (CID 144545564) is 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one.
What is the SMILES notation for 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one?
The canonical SMILES for 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one is CCc1cc(C)c(=O)[nH]c1-c1ccc(F)cc1.
What is the InChIKey of 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one?
The InChIKey is CPEPMYPYWKNIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-3-10-8-9(2)14(17)16-13(10)11-4-6-12(15)7-5-11/h4-8H,3H2,1-2H3,(H,16,17).
What are the key properties of 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one?
5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one has a molecular weight of 231.27 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(4-fluorophenyl)-3-methyl-1H-pyridin-2-one is sourced from PubChem (CID 144545564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).