2-fluoro-5-methylpyridine

C6H6FN — CID 2774635

IUPAC2-fluoro-5-methylpyridine
SMILESCc1ccc(F)nc1
InChIInChI=1S/C6H6FN/c1-5-2-3-6(7)8-4-5/h2-4H,1H3
InChIKeyAOSOZARHUJMBLZ-UHFFFAOYSA-N
MW111.12 g/mol
LogP1.53
Rot. Bonds

About 2-fluoro-5-methylpyridine

2-fluoro-5-methylpyridine (PubChem CID 2774635) has the molecular formula C6H6FN and a molecular weight of 111.12 g/mol. Its IUPAC name is 2-fluoro-5-methylpyridine.

Molecular Properties

Compound Name2-fluoro-5-methylpyridine
PubChem CID2774635
Molecular FormulaC6H6FN
Molecular Weight111.12 g/mol
Exact Mass111.05
IUPAC Name2-fluoro-5-methylpyridine
SMILESCc1ccc(F)nc1
InChIInChI=1S/C6H6FN/c1-5-2-3-6(7)8-4-5/h2-4H,1H3
InChIKeyAOSOZARHUJMBLZ-UHFFFAOYSA-N
XLogP1.53
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.12
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-fluoro-5-methylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methylpyridine?
The IUPAC name of 2-fluoro-5-methylpyridine (CID 2774635) is 2-fluoro-5-methylpyridine.
What is the SMILES notation for 2-fluoro-5-methylpyridine?
The canonical SMILES for 2-fluoro-5-methylpyridine is Cc1ccc(F)nc1.
What is the InChIKey of 2-fluoro-5-methylpyridine?
The InChIKey is AOSOZARHUJMBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6FN/c1-5-2-3-6(7)8-4-5/h2-4H,1H3.
What are the key properties of 2-fluoro-5-methylpyridine?
2-fluoro-5-methylpyridine has a molecular weight of 111.12 g/mol, XLogP of 1.53, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methylpyridine is sourced from PubChem (CID 2774635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).