6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C12H10N4O2S — CID 121249857

IUPAC6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2ccc(S(=O)(=O)c3ccccc3)cn2n1
InChIInChI=1S/C12H10N4O2S/c13-12-14-11-7-6-10(8-16(11)15-12)19(17,18)9-4-2-1-3-5-9/h1-8H,(H2,13,15)
InChIKeyZVZVHOHHGORYAH-UHFFFAOYSA-N
MW274.31 g/mol
LogP1.14
Rot. Bonds2

About 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 121249857) has the molecular formula C12H10N4O2S and a molecular weight of 274.31 g/mol. Its IUPAC name is 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID121249857
Molecular FormulaC12H10N4O2S
Molecular Weight274.31 g/mol
Exact Mass274.05
IUPAC Name6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESNc1nc2ccc(S(=O)(=O)c3ccccc3)cn2n1
InChIInChI=1S/C12H10N4O2S/c13-12-14-11-7-6-10(8-16(11)15-12)19(17,18)9-4-2-1-3-5-9/h1-8H,(H2,13,15)
InChIKeyZVZVHOHHGORYAH-UHFFFAOYSA-N
XLogP1.14
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.31
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-Methyl-(3-phenylsulfonyl)-7,8-dihydro-6H-cyclopenta[e]-pyrazolo[1,5-a]pyrimidin-2-amine
CID 44156628
5-N-(4-aminocyclohexyl)-7-N-[4-(benzenesulfonyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-diamine
CID 11488074
N-[6-(5-Methylsulfonylpyridin-3-Yl)-[1,2,4]triazolo[1,5-A]pyridin-2-Yl]ethanamide
CID 25128663
(5-Chloropyrazolo(1,5-a)Pyrimidin-7-Yl)-(4-Methanesulfonylphenyl)Amine
CID 5287989
N-{3-[(4-Fluorophenyl)sulfonyl]-5,7-dimethylpyrazolo[1,5-A]pyrimidin-2-YL}-N-methylamine
CID 44156622
N-{3-[(3-Fluorophenyl)sulfonyl]-5,7-dimethylpyrazolo[1,5-A]pyrimidin-2-YL}-N-methylamine
CID 44156624
AVN-322 free base
CID 44476436
4-(benzenesulfonyl)-N,11-dimethyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1,3,5,8-tetraen-5-amine
CID 44476607
N,5,7-trimethyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-2-amine
CID 44516817
N-Methyl-N-[7-methyl-3-(phenylsulfonyl)pyrazolo[1,5-A]pyrimidin-2-YL]amine
CID 53326176
N-[7-Amino-5-methyl-3-(phenylsulfonyl)pyrazolo[1,5-A]pyrimidin-2-YL]-N-methylamine
CID 56655504
N-[5-(Aminomethyl)-7-methyl-3-(phenylsulfonyl)pyrazolo[1,5-A]pyrimidin-2-YL]-N-methylamine
CID 56655505

Frequently Asked Questions

What is the IUPAC name of 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 121249857) is 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Nc1nc2ccc(S(=O)(=O)c3ccccc3)cn2n1.
What is the InChIKey of 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is ZVZVHOHHGORYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O2S/c13-12-14-11-7-6-10(8-16(11)15-12)19(17,18)9-4-2-1-3-5-9/h1-8H,(H2,13,15).
What are the key properties of 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 274.31 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(benzenesulfonyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 121249857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).