3-bromo-7-methyltriazolo[1,5-a]pyridine

C7H6BrN3 — CID 83821057

IUPAC3-bromo-7-methyltriazolo[1,5-a]pyridine
SMILESCc1cccc2c(Br)nnn12
InChIInChI=1S/C7H6BrN3/c1-5-3-2-4-6-7(8)9-10-11(5)6/h2-4H,1H3
InChIKeyXNROPQOUIZPNLY-UHFFFAOYSA-N
MW212.05 g/mol
LogP1.80
Rot. Bonds

About 3-bromo-7-methyltriazolo[1,5-a]pyridine

3-bromo-7-methyltriazolo[1,5-a]pyridine (PubChem CID 83821057) has the molecular formula C7H6BrN3 and a molecular weight of 212.05 g/mol. Its IUPAC name is 3-bromo-7-methyltriazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-bromo-7-methyltriazolo[1,5-a]pyridine
PubChem CID83821057
Molecular FormulaC7H6BrN3
Molecular Weight212.05 g/mol
Exact Mass210.97
IUPAC Name3-bromo-7-methyltriazolo[1,5-a]pyridine
SMILESCc1cccc2c(Br)nnn12
InChIInChI=1S/C7H6BrN3/c1-5-3-2-4-6-7(8)9-10-11(5)6/h2-4H,1H3
InChIKeyXNROPQOUIZPNLY-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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Related Compounds

3,7-dimethylpyrazolo[1,5-a]pyridine
CID 142528331
7-methyltriazolo[1,5-a]pyridine
CID 12752362
1-bromo-3-(3-chlorophenyl)-5-methylimidazo[1,5-a]pyridine
CID 84744696
3-methyltriazolo[1,5-a]pyridine-7-carbaldehyde
CID 10374726
3-(1-bromo-5-methylimidazo[1,5-a]pyridin-3-yl)propanoic acid
CID 84743539
1-bromo-5-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744309
2-bromo-4,7-dimethylpyrazolo[1,5-a]pyridine
CID 130065935
1-bromo-N,3-dimethylimidazo[1,5-a]pyridin-5-amine
CID 83898792
2-methoxy-7-methylpyrazolo[1,5-a]pyridin-3-amine;hydrochloride
CID 67181231
(4-bromophenyl)-(7-methylpyrazolo[1,5-a]pyridin-3-yl)methanone;butane
CID 67715193
3-isocyanato-7-methylpyrazolo[1,5-a]pyridine
CID 83914617
1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-5-ol
CID 137005592

Frequently Asked Questions

What is the IUPAC name of 3-bromo-7-methyltriazolo[1,5-a]pyridine?
The IUPAC name of 3-bromo-7-methyltriazolo[1,5-a]pyridine (CID 83821057) is 3-bromo-7-methyltriazolo[1,5-a]pyridine.
What is the SMILES notation for 3-bromo-7-methyltriazolo[1,5-a]pyridine?
The canonical SMILES for 3-bromo-7-methyltriazolo[1,5-a]pyridine is Cc1cccc2c(Br)nnn12.
What is the InChIKey of 3-bromo-7-methyltriazolo[1,5-a]pyridine?
The InChIKey is XNROPQOUIZPNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3/c1-5-3-2-4-6-7(8)9-10-11(5)6/h2-4H,1H3.
What are the key properties of 3-bromo-7-methyltriazolo[1,5-a]pyridine?
3-bromo-7-methyltriazolo[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 3-bromo-7-methyltriazolo[1,5-a]pyridine is sourced from PubChem (CID 83821057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).