2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine

C13H12FNO2 — CID 59191403

IUPAC2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine
SMILESCOc1cc(C)ccc1Oc1cccc(F)n1
InChIInChI=1S/C13H12FNO2/c1-9-6-7-10(11(8-9)16-2)17-13-5-3-4-12(14)15-13/h3-8H,1-2H3
InChIKeyRTVYQNFCJHPRDV-UHFFFAOYSA-N
MW233.24 g/mol
LogP3.33
Rot. Bonds3

About 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine

2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine (PubChem CID 59191403) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine.

Molecular Properties

Compound Name2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine
PubChem CID59191403
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine
SMILESCOc1cc(C)ccc1Oc1cccc(F)n1
InChIInChI=1S/C13H12FNO2/c1-9-6-7-10(11(8-9)16-2)17-13-5-3-4-12(14)15-13/h3-8H,1-2H3
InChIKeyRTVYQNFCJHPRDV-UHFFFAOYSA-N
XLogP3.33
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine 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-6-(2-methoxy-4-methylphenoxy)pyridine?
The IUPAC name of 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine (CID 59191403) is 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine.
What is the SMILES notation for 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine?
The canonical SMILES for 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine is COc1cc(C)ccc1Oc1cccc(F)n1.
What is the InChIKey of 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine?
The InChIKey is RTVYQNFCJHPRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2/c1-9-6-7-10(11(8-9)16-2)17-13-5-3-4-12(14)15-13/h3-8H,1-2H3.
What are the key properties of 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine?
2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine has a molecular weight of 233.24 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(2-methoxy-4-methylphenoxy)pyridine is sourced from PubChem (CID 59191403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).