2-fluoro-6-iodo-3-methoxypyridine

C6H5FINO — CID 130883006

IUPAC2-fluoro-6-iodo-3-methoxypyridine
SMILESCOc1ccc(I)nc1F
InChIInChI=1S/C6H5FINO/c1-10-4-2-3-5(8)9-6(4)7/h2-3H,1H3
InChIKeyLLIOKEOEOYJTEC-UHFFFAOYSA-N
MW253.01 g/mol
LogP1.83
Rot. Bonds1

About 2-fluoro-6-iodo-3-methoxypyridine

2-fluoro-6-iodo-3-methoxypyridine (PubChem CID 130883006) has the molecular formula C6H5FINO and a molecular weight of 253.01 g/mol. Its IUPAC name is 2-fluoro-6-iodo-3-methoxypyridine.

Molecular Properties

Compound Name2-fluoro-6-iodo-3-methoxypyridine
PubChem CID130883006
Molecular FormulaC6H5FINO
Molecular Weight253.01 g/mol
Exact Mass252.94
IUPAC Name2-fluoro-6-iodo-3-methoxypyridine
SMILESCOc1ccc(I)nc1F
InChIInChI=1S/C6H5FINO/c1-10-4-2-3-5(8)9-6(4)7/h2-3H,1H3
InChIKeyLLIOKEOEOYJTEC-UHFFFAOYSA-N
XLogP1.83
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.01
LogP ≤ 51.83
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-iodo-3-methoxypyridine?
The IUPAC name of 2-fluoro-6-iodo-3-methoxypyridine (CID 130883006) is 2-fluoro-6-iodo-3-methoxypyridine.
What is the SMILES notation for 2-fluoro-6-iodo-3-methoxypyridine?
The canonical SMILES for 2-fluoro-6-iodo-3-methoxypyridine is COc1ccc(I)nc1F.
What is the InChIKey of 2-fluoro-6-iodo-3-methoxypyridine?
The InChIKey is LLIOKEOEOYJTEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FINO/c1-10-4-2-3-5(8)9-6(4)7/h2-3H,1H3.
What are the key properties of 2-fluoro-6-iodo-3-methoxypyridine?
2-fluoro-6-iodo-3-methoxypyridine has a molecular weight of 253.01 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-iodo-3-methoxypyridine is sourced from PubChem (CID 130883006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).