2-(3-fluoroprop-1-ynyl)pyridine

C8H6FN — CID 123437689

IUPAC2-(3-fluoroprop-1-ynyl)pyridine
SMILESFCC#Cc1ccccn1
InChIInChI=1S/C8H6FN/c9-6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,6H2
InChIKeyLRIWUESOQHORFJ-UHFFFAOYSA-N
MW135.14 g/mol
LogP1.40
Rot. Bonds

About 2-(3-fluoroprop-1-ynyl)pyridine

2-(3-fluoroprop-1-ynyl)pyridine (PubChem CID 123437689) has the molecular formula C8H6FN and a molecular weight of 135.14 g/mol. Its IUPAC name is 2-(3-fluoroprop-1-ynyl)pyridine.

Molecular Properties

Compound Name2-(3-fluoroprop-1-ynyl)pyridine
PubChem CID123437689
Molecular FormulaC8H6FN
Molecular Weight135.14 g/mol
Exact Mass135.05
IUPAC Name2-(3-fluoroprop-1-ynyl)pyridine
SMILESFCC#Cc1ccccn1
InChIInChI=1S/C8H6FN/c9-6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,6H2
InChIKeyLRIWUESOQHORFJ-UHFFFAOYSA-N
XLogP1.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

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2-[2-[5-(2-pyridin-2-ylethynyl)thiophen-2-yl]ethynyl]pyridine
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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoroprop-1-ynyl)pyridine?
The IUPAC name of 2-(3-fluoroprop-1-ynyl)pyridine (CID 123437689) is 2-(3-fluoroprop-1-ynyl)pyridine.
What is the SMILES notation for 2-(3-fluoroprop-1-ynyl)pyridine?
The canonical SMILES for 2-(3-fluoroprop-1-ynyl)pyridine is FCC#Cc1ccccn1.
What is the InChIKey of 2-(3-fluoroprop-1-ynyl)pyridine?
The InChIKey is LRIWUESOQHORFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN/c9-6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,6H2.
What are the key properties of 2-(3-fluoroprop-1-ynyl)pyridine?
2-(3-fluoroprop-1-ynyl)pyridine has a molecular weight of 135.14 g/mol, XLogP of 1.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoroprop-1-ynyl)pyridine is sourced from PubChem (CID 123437689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).