2,6-difluoro-3-(2-methylphenyl)pyridine

C12H9F2N — CID 166867931

IUPAC2,6-difluoro-3-(2-methylphenyl)pyridine
SMILESCc1ccccc1-c1ccc(F)nc1F
InChIInChI=1S/C12H9F2N/c1-8-4-2-3-5-9(8)10-6-7-11(13)15-12(10)14/h2-7H,1H3
InChIKeyVBHDYIWSXBXCKQ-UHFFFAOYSA-N
MW205.21 g/mol
LogP3.34
Rot. Bonds1

About 2,6-difluoro-3-(2-methylphenyl)pyridine

2,6-difluoro-3-(2-methylphenyl)pyridine (PubChem CID 166867931) has the molecular formula C12H9F2N and a molecular weight of 205.21 g/mol. Its IUPAC name is 2,6-difluoro-3-(2-methylphenyl)pyridine.

Molecular Properties

Compound Name2,6-difluoro-3-(2-methylphenyl)pyridine
PubChem CID166867931
Molecular FormulaC12H9F2N
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2,6-difluoro-3-(2-methylphenyl)pyridine
SMILESCc1ccccc1-c1ccc(F)nc1F
InChIInChI=1S/C12H9F2N/c1-8-4-2-3-5-9(8)10-6-7-11(13)15-12(10)14/h2-7H,1H3
InChIKeyVBHDYIWSXBXCKQ-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 2,6-difluoro-3-(2-methylphenyl)pyridine with MolForge

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

Launch Full Analysis

Related Compounds

3-Phenylpyridine
CID 13886
Sib 1893
CID 5311432
Mpep
CID 3025961
2,3,6-Trimethylpyridine
CID 15100
3-Phenyl-4-propylpyridine
CID 104638
2,6-Diphenylpyridine
CID 72920
3,4-Dimethyl-2,6-diphenylpyridine
CID 3110002
ML318
CID 56604881
(3-Pyridylmethylene)indane 5a
CID 6539763
3-{[(1Z)-5-fluoro-2,3-dihydro-1H-inden-1-ylidene]methyl}pyridine
CID 6539764
(3-Pyridylmethylene)indane 24a
CID 6539783
3-{[(1Z)-4-fluoro-2,3-dihydro-1H-inden-1-ylidene]methyl}pyridine
CID 6539791

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-(2-methylphenyl)pyridine?
The IUPAC name of 2,6-difluoro-3-(2-methylphenyl)pyridine (CID 166867931) is 2,6-difluoro-3-(2-methylphenyl)pyridine.
What is the SMILES notation for 2,6-difluoro-3-(2-methylphenyl)pyridine?
The canonical SMILES for 2,6-difluoro-3-(2-methylphenyl)pyridine is Cc1ccccc1-c1ccc(F)nc1F.
What is the InChIKey of 2,6-difluoro-3-(2-methylphenyl)pyridine?
The InChIKey is VBHDYIWSXBXCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N/c1-8-4-2-3-5-9(8)10-6-7-11(13)15-12(10)14/h2-7H,1H3.
What are the key properties of 2,6-difluoro-3-(2-methylphenyl)pyridine?
2,6-difluoro-3-(2-methylphenyl)pyridine 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 2,6-difluoro-3-(2-methylphenyl)pyridine is sourced from PubChem (CID 166867931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).