7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine

C14H13N3O — CID 117143138

IUPAC7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1ccn2c(-c3ccccc3C)nnc2c1
InChIInChI=1S/C14H13N3O/c1-10-5-3-4-6-12(10)14-16-15-13-9-11(18-2)7-8-17(13)14/h3-9H,1-2H3
InChIKeyQZSXBQDCPDPZRL-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.71
Rot. Bonds2

About 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine

7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117143138) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117143138
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1ccn2c(-c3ccccc3C)nnc2c1
InChIInChI=1S/C14H13N3O/c1-10-5-3-4-6-12(10)14-16-15-13-9-11(18-2)7-8-17(13)14/h3-9H,1-2H3
InChIKeyQZSXBQDCPDPZRL-UHFFFAOYSA-N
XLogP2.71
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-7-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117143156
3-(2,4-dimethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 4730548
7-methoxy-[1,2,4]triazolo[4,3-a]pyridine-3-carbaldehyde
CID 105436739
4-methoxy-2-methyl-1-(2-methylphenyl)benzene
CID 12981832
4-[7-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
CID 53393051
ethane;3-(2-fluorophenyl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 145469042
7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117143112
9-methoxy-2-(2-methylphenyl)imidazo[2,1-a]isoquinolin-3-amine
CID 18691101
3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-ol
CID 117139829
methyl 3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 115384822
2-(7-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetic acid
CID 105459905
7-methoxy-3-[[2-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117143079

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine (CID 117143138) is 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine is COc1ccn2c(-c3ccccc3C)nnc2c1.
What is the InChIKey of 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is QZSXBQDCPDPZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-10-5-3-4-6-12(10)14-16-15-13-9-11(18-2)7-8-17(13)14/h3-9H,1-2H3.
What are the key properties of 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine?
7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 239.28 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117143138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).