8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C13H12N4O2S — CID 67481522

IUPAC8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCS(=O)(=O)c1ccccc1-c1cccn2nc(N)nc12
InChIInChI=1S/C13H12N4O2S/c1-20(18,19)11-7-3-2-5-9(11)10-6-4-8-17-12(10)15-13(14)16-17/h2-8H,1H3,(H2,14,16)
InChIKeyWFTYTZQZTHKNLL-UHFFFAOYSA-N
MW288.33 g/mol
LogP1.38
Rot. Bonds2

About 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 67481522) has the molecular formula C13H12N4O2S and a molecular weight of 288.33 g/mol. Its IUPAC name is 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID67481522
Molecular FormulaC13H12N4O2S
Molecular Weight288.33 g/mol
Exact Mass288.07
IUPAC Name8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCS(=O)(=O)c1ccccc1-c1cccn2nc(N)nc12
InChIInChI=1S/C13H12N4O2S/c1-20(18,19)11-7-3-2-5-9(11)10-6-4-8-17-12(10)15-13(14)16-17/h2-8H,1H3,(H2,14,16)
InChIKeyWFTYTZQZTHKNLL-UHFFFAOYSA-N
XLogP1.38
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 67481522) is 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is CS(=O)(=O)c1ccccc1-c1cccn2nc(N)nc12.
What is the InChIKey of 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is WFTYTZQZTHKNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2S/c1-20(18,19)11-7-3-2-5-9(11)10-6-4-8-17-12(10)15-13(14)16-17/h2-8H,1H3,(H2,14,16).
What are the key properties of 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 288.33 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 67481522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).