3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol

C13H11N3O — CID 117139829

IUPAC3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
SMILESCc1ccccc1-c1nnc2ccc(O)cn12
InChIInChI=1S/C13H11N3O/c1-9-4-2-3-5-11(9)13-15-14-12-7-6-10(17)8-16(12)13/h2-8,17H,1H3
InChIKeyURTJTQATUBMODU-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.41
Rot. Bonds1

About 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol

3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol (PubChem CID 117139829) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol.

Molecular Properties

Compound Name3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
PubChem CID117139829
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
SMILESCc1ccccc1-c1nnc2ccc(O)cn12
InChIInChI=1S/C13H11N3O/c1-9-4-2-3-5-11(9)13-15-14-12-7-6-10(17)8-16(12)13/h2-8,17H,1H3
InChIKeyURTJTQATUBMODU-UHFFFAOYSA-N
XLogP2.41
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
CID 137006539
6-methyl-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117139828
3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
CID 117139848
methyl 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 115384822
2-(6-amino-[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenol
CID 137006538
6-hydroxy-3-(2-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251391
3-(2,3-dimethylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
CID 105392740
7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117143138
5-methyl-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061327
3-(2-chloro-3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
CID 105392680
3-(2-methylsulfanylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 79205858
5-(2-methylphenyl)-3-(3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-1,2,4-oxadiazole
CID 53173292

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol?
The IUPAC name of 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol (CID 117139829) is 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol.
What is the SMILES notation for 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol?
The canonical SMILES for 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol is Cc1ccccc1-c1nnc2ccc(O)cn12.
What is the InChIKey of 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol?
The InChIKey is URTJTQATUBMODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-9-4-2-3-5-11(9)13-15-14-12-7-6-10(17)8-16(12)13/h2-8,17H,1H3.
What are the key properties of 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol?
3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol has a molecular weight of 225.25 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol is sourced from PubChem (CID 117139829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).