4-fluoro-2-methylidene-1H-pyridine

C6H6FN — CID 156651866

IUPAC4-fluoro-2-methylidene-1H-pyridine
SMILESC=C1C=C(F)C=CN1
InChIInChI=1S/C6H6FN/c1-5-4-6(7)2-3-8-5/h2-4,8H,1H2
InChIKeyLDSYAIUPDKXADS-UHFFFAOYSA-N
MW111.12 g/mol
LogP1.47
Rot. Bonds

About 4-fluoro-2-methylidene-1H-pyridine

4-fluoro-2-methylidene-1H-pyridine (PubChem CID 156651866) has the molecular formula C6H6FN and a molecular weight of 111.12 g/mol. Its IUPAC name is 4-fluoro-2-methylidene-1H-pyridine.

Molecular Properties

Compound Name4-fluoro-2-methylidene-1H-pyridine
PubChem CID156651866
Molecular FormulaC6H6FN
Molecular Weight111.12 g/mol
Exact Mass111.05
IUPAC Name4-fluoro-2-methylidene-1H-pyridine
SMILESC=C1C=C(F)C=CN1
InChIInChI=1S/C6H6FN/c1-5-4-6(7)2-3-8-5/h2-4,8H,1H2
InChIKeyLDSYAIUPDKXADS-UHFFFAOYSA-N
XLogP1.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.12
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methylidene-1H-pyridine?
The IUPAC name of 4-fluoro-2-methylidene-1H-pyridine (CID 156651866) is 4-fluoro-2-methylidene-1H-pyridine.
What is the SMILES notation for 4-fluoro-2-methylidene-1H-pyridine?
The canonical SMILES for 4-fluoro-2-methylidene-1H-pyridine is C=C1C=C(F)C=CN1.
What is the InChIKey of 4-fluoro-2-methylidene-1H-pyridine?
The InChIKey is LDSYAIUPDKXADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6FN/c1-5-4-6(7)2-3-8-5/h2-4,8H,1H2.
What are the key properties of 4-fluoro-2-methylidene-1H-pyridine?
4-fluoro-2-methylidene-1H-pyridine has a molecular weight of 111.12 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methylidene-1H-pyridine is sourced from PubChem (CID 156651866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).