6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine

C6H3FIN3 — CID 162381856

IUPAC6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1cn2ncnc2cc1I
InChIInChI=1S/C6H3FIN3/c7-4-2-11-6(1-5(4)8)9-3-10-11/h1-3H
InChIKeyTWNJQARHJCDMEH-UHFFFAOYSA-N
MW263.01 g/mol
LogP1.47
Rot. Bonds

About 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine

6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 162381856) has the molecular formula C6H3FIN3 and a molecular weight of 263.01 g/mol. Its IUPAC name is 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID162381856
Molecular FormulaC6H3FIN3
Molecular Weight263.01 g/mol
Exact Mass262.94
IUPAC Name6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1cn2ncnc2cc1I
InChIInChI=1S/C6H3FIN3/c7-4-2-11-6(1-5(4)8)9-3-10-11/h1-3H
InChIKeyTWNJQARHJCDMEH-UHFFFAOYSA-N
XLogP1.47
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.01
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine (CID 162381856) is 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine is Fc1cn2ncnc2cc1I.
What is the InChIKey of 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is TWNJQARHJCDMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3FIN3/c7-4-2-11-6(1-5(4)8)9-3-10-11/h1-3H.
What are the key properties of 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine?
6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 263.01 g/mol, XLogP of 1.47, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-7-iodo-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 162381856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).