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

C7H8FNO — CID 91455016

IUPAC5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one
SMILESC=C1C=C(F)C(=O)N(C)C1
InChIInChI=1S/C7H8FNO/c1-5-3-6(8)7(10)9(2)4-5/h3H,1,4H2,2H3
InChIKeySXGZVHGAQDXBOS-UHFFFAOYSA-N
MW141.14 g/mol
LogP0.87
Rot. Bonds

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

5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one (PubChem CID 91455016) has the molecular formula C7H8FNO and a molecular weight of 141.14 g/mol. Its IUPAC name is 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one.

Molecular Properties

Compound Name5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one
PubChem CID91455016
Molecular FormulaC7H8FNO
Molecular Weight141.14 g/mol
Exact Mass141.06
IUPAC Name5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one
SMILESC=C1C=C(F)C(=O)N(C)C1
InChIInChI=1S/C7H8FNO/c1-5-3-6(8)7(10)9(2)4-5/h3H,1,4H2,2H3
InChIKeySXGZVHGAQDXBOS-UHFFFAOYSA-N
XLogP0.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.14
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one?
The IUPAC name of 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one (CID 91455016) is 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one.
What is the SMILES notation for 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one?
The canonical SMILES for 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one is C=C1C=C(F)C(=O)N(C)C1.
What is the InChIKey of 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one?
The InChIKey is SXGZVHGAQDXBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO/c1-5-3-6(8)7(10)9(2)4-5/h3H,1,4H2,2H3.
What are the key properties of 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one?
5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one has a molecular weight of 141.14 g/mol, XLogP of 0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-methyl-3-methylidene-2H-pyridin-6-one is sourced from PubChem (CID 91455016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).