2-fluoro-3-(2-fluorophenyl)-4-methylpyridine

C12H9F2N — CID 46312589

IUPAC2-fluoro-3-(2-fluorophenyl)-4-methylpyridine
SMILESCc1ccnc(F)c1-c1ccccc1F
InChIInChI=1S/C12H9F2N/c1-8-6-7-15-12(14)11(8)9-4-2-3-5-10(9)13/h2-7H,1H3
InChIKeyHLDMAEJUFMHITF-UHFFFAOYSA-N
MW205.21 g/mol
LogP3.34
Rot. Bonds1

About 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine

2-fluoro-3-(2-fluorophenyl)-4-methylpyridine (PubChem CID 46312589) has the molecular formula C12H9F2N and a molecular weight of 205.21 g/mol. Its IUPAC name is 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine.

Molecular Properties

Compound Name2-fluoro-3-(2-fluorophenyl)-4-methylpyridine
PubChem CID46312589
Molecular FormulaC12H9F2N
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2-fluoro-3-(2-fluorophenyl)-4-methylpyridine
SMILESCc1ccnc(F)c1-c1ccccc1F
InChIInChI=1S/C12H9F2N/c1-8-6-7-15-12(14)11(8)9-4-2-3-5-10(9)13/h2-7H,1H3
InChIKeyHLDMAEJUFMHITF-UHFFFAOYSA-N
XLogP3.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-fluoro-3-(2-fluorophenyl)-4-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-3-(2-fluorophenyl)-4-methylpyridine?
The IUPAC name of 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine (CID 46312589) is 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine.
What is the SMILES notation for 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine?
The canonical SMILES for 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine is Cc1ccnc(F)c1-c1ccccc1F.
What is the InChIKey of 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine?
The InChIKey is HLDMAEJUFMHITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N/c1-8-6-7-15-12(14)11(8)9-4-2-3-5-10(9)13/h2-7H,1H3.
What are the key properties of 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine?
2-fluoro-3-(2-fluorophenyl)-4-methylpyridine has a molecular weight of 205.21 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(2-fluorophenyl)-4-methylpyridine is sourced from PubChem (CID 46312589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).