2-(difluoromethoxy)-3-fluoro-6-iodopyridine

C6H3F3INO — CID 119020596

IUPAC2-(difluoromethoxy)-3-fluoro-6-iodopyridine
SMILESFc1ccc(I)nc1OC(F)F
InChIInChI=1S/C6H3F3INO/c7-3-1-2-4(10)11-5(3)12-6(8)9/h1-2,6H
InChIKeyOLMQAOZNEAOODW-UHFFFAOYSA-N
MW288.99 g/mol
LogP2.43
Rot. Bonds2

About 2-(difluoromethoxy)-3-fluoro-6-iodopyridine

2-(difluoromethoxy)-3-fluoro-6-iodopyridine (PubChem CID 119020596) has the molecular formula C6H3F3INO and a molecular weight of 288.99 g/mol. Its IUPAC name is 2-(difluoromethoxy)-3-fluoro-6-iodopyridine.

Molecular Properties

Compound Name2-(difluoromethoxy)-3-fluoro-6-iodopyridine
PubChem CID119020596
Molecular FormulaC6H3F3INO
Molecular Weight288.99 g/mol
Exact Mass288.92
IUPAC Name2-(difluoromethoxy)-3-fluoro-6-iodopyridine
SMILESFc1ccc(I)nc1OC(F)F
InChIInChI=1S/C6H3F3INO/c7-3-1-2-4(10)11-5(3)12-6(8)9/h1-2,6H
InChIKeyOLMQAOZNEAOODW-UHFFFAOYSA-N
XLogP2.43
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.99
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(difluoromethoxy)-3-fluoro-6-iodopyridine 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-(difluoromethoxy)-3-fluoro-6-iodopyridine?
The IUPAC name of 2-(difluoromethoxy)-3-fluoro-6-iodopyridine (CID 119020596) is 2-(difluoromethoxy)-3-fluoro-6-iodopyridine.
What is the SMILES notation for 2-(difluoromethoxy)-3-fluoro-6-iodopyridine?
The canonical SMILES for 2-(difluoromethoxy)-3-fluoro-6-iodopyridine is Fc1ccc(I)nc1OC(F)F.
What is the InChIKey of 2-(difluoromethoxy)-3-fluoro-6-iodopyridine?
The InChIKey is OLMQAOZNEAOODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F3INO/c7-3-1-2-4(10)11-5(3)12-6(8)9/h1-2,6H.
What are the key properties of 2-(difluoromethoxy)-3-fluoro-6-iodopyridine?
2-(difluoromethoxy)-3-fluoro-6-iodopyridine has a molecular weight of 288.99 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-3-fluoro-6-iodopyridine is sourced from PubChem (CID 119020596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).