2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine

C7H6BrN3 — CID 71711015

IUPAC2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2nc(Br)nn2c1
InChIInChI=1S/C7H6BrN3/c1-5-2-3-6-9-7(8)10-11(6)4-5/h2-4H,1H3
InChIKeyXSNPZBHCNPBGJJ-UHFFFAOYSA-N
MW212.05 g/mol
LogP1.80
Rot. Bonds

About 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine

2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 71711015) has the molecular formula C7H6BrN3 and a molecular weight of 212.05 g/mol. Its IUPAC name is 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID71711015
Molecular FormulaC7H6BrN3
Molecular Weight212.05 g/mol
Exact Mass210.97
IUPAC Name2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2nc(Br)nn2c1
InChIInChI=1S/C7H6BrN3/c1-5-2-3-6-9-7(8)10-11(6)4-5/h2-4H,1H3
InChIKeyXSNPZBHCNPBGJJ-UHFFFAOYSA-N
XLogP1.80
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.05
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine (CID 71711015) is 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccc2nc(Br)nn2c1.
What is the InChIKey of 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is XSNPZBHCNPBGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3/c1-5-2-3-6-9-7(8)10-11(6)4-5/h2-4H,1H3.
What are the key properties of 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 212.05 g/mol, XLogP of 1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 71711015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).