2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide

C14H15N5O3S — CID 141242923

IUPAC2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide
SMILESNc1nc2ccc(-c3ccccc3S(=O)(=O)NCCO)cn2n1
InChIInChI=1S/C14H15N5O3S/c15-14-17-13-6-5-10(9-19(13)18-14)11-3-1-2-4-12(11)23(21,22)16-7-8-20/h1-6,9,16,20H,7-8H2,(H2,15,18)
InChIKeyKNQFMODNNAFCEV-UHFFFAOYSA-N
MW333.37 g/mol
LogP0.25
Rot. Bonds5

About 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide

2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide (PubChem CID 141242923) has the molecular formula C14H15N5O3S and a molecular weight of 333.37 g/mol. Its IUPAC name is 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide
PubChem CID141242923
Molecular FormulaC14H15N5O3S
Molecular Weight333.37 g/mol
Exact Mass333.09
IUPAC Name2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide
SMILESNc1nc2ccc(-c3ccccc3S(=O)(=O)NCCO)cn2n1
InChIInChI=1S/C14H15N5O3S/c15-14-17-13-6-5-10(9-19(13)18-14)11-3-1-2-4-12(11)23(21,22)16-7-8-20/h1-6,9,16,20H,7-8H2,(H2,15,18)
InChIKeyKNQFMODNNAFCEV-UHFFFAOYSA-N
XLogP0.25
TPSA122.61 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide?
The IUPAC name of 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide (CID 141242923) is 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide.
What is the SMILES notation for 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide?
The canonical SMILES for 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide is Nc1nc2ccc(-c3ccccc3S(=O)(=O)NCCO)cn2n1.
What is the InChIKey of 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide?
The InChIKey is KNQFMODNNAFCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O3S/c15-14-17-13-6-5-10(9-19(13)18-14)11-3-1-2-4-12(11)23(21,22)16-7-8-20/h1-6,9,16,20H,7-8H2,(H2,15,18).
What are the key properties of 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide?
2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide has a molecular weight of 333.37 g/mol, XLogP of 0.25, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-(2-hydroxyethyl)benzenesulfonamide is sourced from PubChem (CID 141242923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).