2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine

C11H8BrN3O — CID 82566420

IUPAC2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2nc(-c3ccc(Br)o3)nn2c1
InChIInChI=1S/C11H8BrN3O/c1-7-2-5-10-13-11(14-15(10)6-7)8-3-4-9(12)16-8/h2-6H,1H3
InChIKeyRKBDDMMLFUEEEE-UHFFFAOYSA-N
MW278.11 g/mol
LogP3.06
Rot. Bonds1

About 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine

2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 82566420) has the molecular formula C11H8BrN3O and a molecular weight of 278.11 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID82566420
Molecular FormulaC11H8BrN3O
Molecular Weight278.11 g/mol
Exact Mass276.99
IUPAC Name2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc2nc(-c3ccc(Br)o3)nn2c1
InChIInChI=1S/C11H8BrN3O/c1-7-2-5-10-13-11(14-15(10)6-7)8-3-4-9(12)16-8/h2-6H,1H3
InChIKeyRKBDDMMLFUEEEE-UHFFFAOYSA-N
XLogP3.06
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.11
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 71711015
2-(5-bromofuran-2-yl)-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117134762
2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 117130193
2-(5-bromofuran-2-yl)-5-chloro-[1,2,4]triazolo[1,5-a]pyridine
CID 117132460
2-(4-methoxyphenyl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 82566386
2-(4-tert-butylphenyl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 82566407
2-[2-(5-bromofuran-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 13259035
2-chloro-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 83816027
4-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)benzoic acid
CID 117127908
3-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 82566380
2-(5-bromofuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 82566958
3-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)aniline
CID 82566376

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine (CID 82566420) is 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccc2nc(-c3ccc(Br)o3)nn2c1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is RKBDDMMLFUEEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrN3O/c1-7-2-5-10-13-11(14-15(10)6-7)8-3-4-9(12)16-8/h2-6H,1H3.
What are the key properties of 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine?
2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 278.11 g/mol, XLogP of 3.06, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-6-methyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 82566420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).