5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine

C13H11N3O — CID 71479965

IUPAC5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc(Oc2cccc3nncn23)cc1
InChIInChI=1S/C13H11N3O/c1-10-5-7-11(8-6-10)17-13-4-2-3-12-15-14-9-16(12)13/h2-9H,1H3
InChIKeyJPWNDSIFEAIGDM-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.83
Rot. Bonds2

About 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine

5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 71479965) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID71479965
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc(Oc2cccc3nncn23)cc1
InChIInChI=1S/C13H11N3O/c1-10-5-7-11(8-6-10)17-13-4-2-3-12-15-14-9-16(12)13/h2-9H,1H3
InChIKeyJPWNDSIFEAIGDM-UHFFFAOYSA-N
XLogP2.83
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-fluorophenoxy)-[1,2,4]triazolo[4,3-a]pyridine
CID 71480078
5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
CID 71479963
6-(4-methylphenoxy)-[1,2,4]triazolo[4,3-b]pyridazine
CID 46202816
1-methyl-4-(4-methylphenoxy)benzene;dihydrofluoride
CID 174481204
1-methyl-4-(4-methylphenoxy)benzene;1,3-xylene;1,4-xylene
CID 159470463
(4-methylphenyl) [1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate
CID 123246029
1,5-bis(4-methylphenoxy)naphthalene;methane
CID 159940982
1-[2-fluoro-6-(4-methylphenoxy)phenyl]-N-methylethanamine
CID 43285104
1-methyl-4-[4-[[4-[4-[[4-[4-[[4-(4-methylphenoxy)phenyl]methyl]phenoxy]phenyl]methyl]phenoxy]phenyl]methyl]phenoxy]benzene
CID 130432775
2-(4-methylphenyl)-5-[4-[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]phenoxy]phenyl]-1,3,4-oxadiazole
CID 20603457
2-[4-[4-[[4,6-bis(4-methylphenoxy)-1,3,5-triazin-2-yl]oxy]phenyl]phenoxy]-4,6-bis(4-methylphenoxy)-1,3,5-triazine
CID 169281032
[4-[3-[4-(4-methylbenzoyl)phenoxy]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 90192164

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine (CID 71479965) is 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine is Cc1ccc(Oc2cccc3nncn23)cc1.
What is the InChIKey of 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is JPWNDSIFEAIGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-10-5-7-11(8-6-10)17-13-4-2-3-12-15-14-9-16(12)13/h2-9H,1H3.
What are the key properties of 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 225.25 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 71479965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).