2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine

C8H9FINO2 — CID 177237388

IUPAC2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine
SMILESCOCCOc1cc(I)cc(F)n1
InChIInChI=1S/C8H9FINO2/c1-12-2-3-13-8-5-6(10)4-7(9)11-8/h4-5H,2-3H2,1H3
InChIKeyNTCGIQXPRBAGOB-UHFFFAOYSA-N
MW297.07 g/mol
LogP1.85
Rot. Bonds4

About 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine

2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine (PubChem CID 177237388) has the molecular formula C8H9FINO2 and a molecular weight of 297.07 g/mol. Its IUPAC name is 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine.

Molecular Properties

Compound Name2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine
PubChem CID177237388
Molecular FormulaC8H9FINO2
Molecular Weight297.07 g/mol
Exact Mass296.97
IUPAC Name2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine
SMILESCOCCOc1cc(I)cc(F)n1
InChIInChI=1S/C8H9FINO2/c1-12-2-3-13-8-5-6(10)4-7(9)11-8/h4-5H,2-3H2,1H3
InChIKeyNTCGIQXPRBAGOB-UHFFFAOYSA-N
XLogP1.85
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.07
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-fluoro-4-iodo-6-(2-methoxyethoxy)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-4-iodo-6-(2-methoxyethoxy)pyridine?
The IUPAC name of 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine (CID 177237388) is 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine.
What is the SMILES notation for 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine?
The canonical SMILES for 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine is COCCOc1cc(I)cc(F)n1.
What is the InChIKey of 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine?
The InChIKey is NTCGIQXPRBAGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FINO2/c1-12-2-3-13-8-5-6(10)4-7(9)11-8/h4-5H,2-3H2,1H3.
What are the key properties of 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine?
2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine has a molecular weight of 297.07 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine is sourced from PubChem (CID 177237388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).