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

C13H11N3O — CID 71479963

IUPAC5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccccc1Oc1cccc2nncn12
InChIInChI=1S/C13H11N3O/c1-10-5-2-3-6-11(10)17-13-8-4-7-12-15-14-9-16(12)13/h2-9H,1H3
InChIKeyKOTRJFHNPAUZFO-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.83
Rot. Bonds2

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

5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 71479963) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID71479963
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccccc1Oc1cccc2nncn12
InChIInChI=1S/C13H11N3O/c1-10-5-2-3-6-11(10)17-13-8-4-7-12-15-14-9-16(12)13/h2-9H,1H3
InChIKeyKOTRJFHNPAUZFO-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

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Related Compounds

5-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine
CID 71479965
5-pentoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 71479874
ethane;1-methyl-2-(2-methylphenoxy)benzene
CID 90755051
1,2,3-tris(2-methylphenoxy)benzene
CID 139940567
3-[(2-methylphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117256976
[1,2,4]triazolo[4,3-a]pyridin-5-ylmethanol
CID 122200646
[2-(2-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 43478692
9-methyl-5-phenyl-[1,2,4]triazolo[4,3-a]quinoline
CID 25186767
5-chloro-3-(2-methylphenoxy)pyridazine
CID 23013925
methyl-(2-methylphenoxy)borinic acid
CID 90155517
ethane;1-methyl-2-phenoxybenzene
CID 90950955
2,2,4,4,6,6,8,8-octakis(2-methylphenoxy)-1,3,5,7-tetraza-2λ5,4λ5,6λ5,8λ5-tetraphosphacycloocta-1,3,5,7-tetraene
CID 140957011

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine (CID 71479963) is 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine is Cc1ccccc1Oc1cccc2nncn12.
What is the InChIKey of 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is KOTRJFHNPAUZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-10-5-2-3-6-11(10)17-13-8-4-7-12-15-14-9-16(12)13/h2-9H,1H3.
What are the key properties of 5-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine?
5-(2-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-(2-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 71479963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).