5-fluoro-1,3-dimethylpyridin-2-one

C7H8FNO — CID 66924425

IUPAC5-fluoro-1,3-dimethylpyridin-2-one
SMILESCc1cc(F)cn(C)c1=O
InChIInChI=1S/C7H8FNO/c1-5-3-6(8)4-9(2)7(5)10/h3-4H,1-2H3
InChIKeyYTZXJRJEIBRJFC-UHFFFAOYSA-N
MW141.14 g/mol
LogP0.83
Rot. Bonds

About 5-fluoro-1,3-dimethylpyridin-2-one

5-fluoro-1,3-dimethylpyridin-2-one (PubChem CID 66924425) has the molecular formula C7H8FNO and a molecular weight of 141.14 g/mol. Its IUPAC name is 5-fluoro-1,3-dimethylpyridin-2-one.

Molecular Properties

Compound Name5-fluoro-1,3-dimethylpyridin-2-one
PubChem CID66924425
Molecular FormulaC7H8FNO
Molecular Weight141.14 g/mol
Exact Mass141.06
IUPAC Name5-fluoro-1,3-dimethylpyridin-2-one
SMILESCc1cc(F)cn(C)c1=O
InChIInChI=1S/C7H8FNO/c1-5-3-6(8)4-9(2)7(5)10/h3-4H,1-2H3
InChIKeyYTZXJRJEIBRJFC-UHFFFAOYSA-N
XLogP0.83
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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CID 60150205
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CID 66924423
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CID 66924543

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1,3-dimethylpyridin-2-one?
The IUPAC name of 5-fluoro-1,3-dimethylpyridin-2-one (CID 66924425) is 5-fluoro-1,3-dimethylpyridin-2-one.
What is the SMILES notation for 5-fluoro-1,3-dimethylpyridin-2-one?
The canonical SMILES for 5-fluoro-1,3-dimethylpyridin-2-one is Cc1cc(F)cn(C)c1=O.
What is the InChIKey of 5-fluoro-1,3-dimethylpyridin-2-one?
The InChIKey is YTZXJRJEIBRJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO/c1-5-3-6(8)4-9(2)7(5)10/h3-4H,1-2H3.
What are the key properties of 5-fluoro-1,3-dimethylpyridin-2-one?
5-fluoro-1,3-dimethylpyridin-2-one has a molecular weight of 141.14 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1,3-dimethylpyridin-2-one is sourced from PubChem (CID 66924425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).