2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine

C7H5BrFN3O — CID 129216603

IUPAC2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1cc(F)cn2nc(Br)nc12
InChIInChI=1S/C7H5BrFN3O/c1-13-5-2-4(9)3-12-6(5)10-7(8)11-12/h2-3H,1H3
InChIKeyMOYOSVUGFKIGCC-UHFFFAOYSA-N
MW246.04 g/mol
LogP1.64
Rot. Bonds1

About 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine

2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 129216603) has the molecular formula C7H5BrFN3O and a molecular weight of 246.04 g/mol. Its IUPAC name is 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID129216603
Molecular FormulaC7H5BrFN3O
Molecular Weight246.04 g/mol
Exact Mass244.96
IUPAC Name2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1cc(F)cn2nc(Br)nc12
InChIInChI=1S/C7H5BrFN3O/c1-13-5-2-4(9)3-12-6(5)10-7(8)11-12/h2-3H,1H3
InChIKeyMOYOSVUGFKIGCC-UHFFFAOYSA-N
XLogP1.64
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.04
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine (CID 129216603) is 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine is COc1cc(F)cn2nc(Br)nc12.
What is the InChIKey of 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is MOYOSVUGFKIGCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrFN3O/c1-13-5-2-4(9)3-12-6(5)10-7(8)11-12/h2-3H,1H3.
What are the key properties of 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine?
2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 246.04 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-fluoro-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 129216603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).