2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol

C12H8BrN3O — CID 136927128

IUPAC2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
SMILESOc1ccccc1-c1nc2c(Br)cccn2n1
InChIInChI=1S/C12H8BrN3O/c13-9-5-3-7-16-12(9)14-11(15-16)8-4-1-2-6-10(8)17/h1-7,17H
InChIKeyQPXCXCAQKMKSNA-UHFFFAOYSA-N
MW290.12 g/mol
LogP2.86
Rot. Bonds1

About 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol

2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol (PubChem CID 136927128) has the molecular formula C12H8BrN3O and a molecular weight of 290.12 g/mol. Its IUPAC name is 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol.

Molecular Properties

Compound Name2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
PubChem CID136927128
Molecular FormulaC12H8BrN3O
Molecular Weight290.12 g/mol
Exact Mass288.99
IUPAC Name2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
SMILESOc1ccccc1-c1nc2c(Br)cccn2n1
InChIInChI=1S/C12H8BrN3O/c13-9-5-3-7-16-12(9)14-11(15-16)8-4-1-2-6-10(8)17/h1-7,17H
InChIKeyQPXCXCAQKMKSNA-UHFFFAOYSA-N
XLogP2.86
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.12
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565554
8-bromo-2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117137616
2-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565550
2-(7-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 136927173
8-bromo-2-nitro-[1,2,4]triazolo[1,5-a]pyridine
CID 83899512
methyl 2-[2-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 82567017
8-bromo-2-(phenoxymethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117258015
3-[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-2,3-dimethylbutan-2-ol
CID 114156328
2-(2-fluorophenyl)-8-nitro-[1,2,4]triazolo[1,5-a]pyridine
CID 82566561
4-(2-bromophenyl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
CID 135455834
4-[2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]benzoic acid
CID 123222984
2-(8-bromoimidazo[1,5-a]pyridin-3-yl)phenol
CID 137006642

Frequently Asked Questions

What is the IUPAC name of 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The IUPAC name of 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol (CID 136927128) is 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol.
What is the SMILES notation for 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The canonical SMILES for 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol is Oc1ccccc1-c1nc2c(Br)cccn2n1.
What is the InChIKey of 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
The InChIKey is QPXCXCAQKMKSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrN3O/c13-9-5-3-7-16-12(9)14-11(15-16)8-4-1-2-6-10(8)17/h1-7,17H.
What are the key properties of 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol?
2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol has a molecular weight of 290.12 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol is sourced from PubChem (CID 136927128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).