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

C6H3BrFN3 — CID 131541116

IUPAC2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1ccn2nc(Br)nc2c1
InChIInChI=1S/C6H3BrFN3/c7-6-9-5-3-4(8)1-2-11(5)10-6/h1-3H
InChIKeyJFUXQVUMKDPGJP-UHFFFAOYSA-N
MW216.01 g/mol
LogP1.63
Rot. Bonds

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

2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 131541116) has the molecular formula C6H3BrFN3 and a molecular weight of 216.01 g/mol. Its IUPAC name is 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID131541116
Molecular FormulaC6H3BrFN3
Molecular Weight216.01 g/mol
Exact Mass214.95
IUPAC Name2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1ccn2nc(Br)nc2c1
InChIInChI=1S/C6H3BrFN3/c7-6-9-5-3-4(8)1-2-11(5)10-6/h1-3H
InChIKeyJFUXQVUMKDPGJP-UHFFFAOYSA-N
XLogP1.63
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.01
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine (CID 131541116) is 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine is Fc1ccn2nc(Br)nc2c1.
What is the InChIKey of 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is JFUXQVUMKDPGJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrFN3/c7-6-9-5-3-4(8)1-2-11(5)10-6/h1-3H.
What are the key properties of 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine?
2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 216.01 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-7-fluoro-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 131541116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).