4-fluoro-4H-pyridine

C5H4FN — CID 125460466

IUPAC4-fluoro-4H-pyridine
SMILESFC1C=C=NC=C1
InChIInChI=1S/C5H4FN/c6-5-1-3-7-4-2-5/h1-3,5H
InChIKeyMOKWFTWQCYOIKI-UHFFFAOYSA-N
MW97.09 g/mol
LogP1.08
Rot. Bonds

About 4-fluoro-4H-pyridine

4-fluoro-4H-pyridine (PubChem CID 125460466) has the molecular formula C5H4FN and a molecular weight of 97.09 g/mol. Its IUPAC name is 4-fluoro-4H-pyridine.

Molecular Properties

Compound Name4-fluoro-4H-pyridine
PubChem CID125460466
Molecular FormulaC5H4FN
Molecular Weight97.09 g/mol
Exact Mass97.03
IUPAC Name4-fluoro-4H-pyridine
SMILESFC1C=C=NC=C1
InChIInChI=1S/C5H4FN/c6-5-1-3-7-4-2-5/h1-3,5H
InChIKeyMOKWFTWQCYOIKI-UHFFFAOYSA-N
XLogP1.08
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.09
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-4H-pyridine?
The IUPAC name of 4-fluoro-4H-pyridine (CID 125460466) is 4-fluoro-4H-pyridine.
What is the SMILES notation for 4-fluoro-4H-pyridine?
The canonical SMILES for 4-fluoro-4H-pyridine is FC1C=C=NC=C1.
What is the InChIKey of 4-fluoro-4H-pyridine?
The InChIKey is MOKWFTWQCYOIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4FN/c6-5-1-3-7-4-2-5/h1-3,5H.
What are the key properties of 4-fluoro-4H-pyridine?
4-fluoro-4H-pyridine has a molecular weight of 97.09 g/mol, XLogP of 1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-4H-pyridine is sourced from PubChem (CID 125460466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).