3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one

C8H10FNO — CID 167302086

IUPAC3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one
SMILESCCc1cc(F)c(C)[nH]c1=O
InChIInChI=1S/C8H10FNO/c1-3-6-4-7(9)5(2)10-8(6)11/h4H,3H2,1-2H3,(H,10,11)
InChIKeyYJKBAWJDKDVGNU-UHFFFAOYSA-N
MW155.17 g/mol
LogP1.38
Rot. Bonds1

About 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one

3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one (PubChem CID 167302086) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one
PubChem CID167302086
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one
SMILESCCc1cc(F)c(C)[nH]c1=O
InChIInChI=1S/C8H10FNO/c1-3-6-4-7(9)5(2)10-8(6)11/h4H,3H2,1-2H3,(H,10,11)
InChIKeyYJKBAWJDKDVGNU-UHFFFAOYSA-N
XLogP1.38
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one?
The IUPAC name of 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one (CID 167302086) is 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one.
What is the SMILES notation for 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one?
The canonical SMILES for 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one is CCc1cc(F)c(C)[nH]c1=O.
What is the InChIKey of 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one?
The InChIKey is YJKBAWJDKDVGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-3-6-4-7(9)5(2)10-8(6)11/h4H,3H2,1-2H3,(H,10,11).
What are the key properties of 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one?
3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one has a molecular weight of 155.17 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-fluoro-6-methyl-1H-pyridin-2-one is sourced from PubChem (CID 167302086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).