2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide

C11H14N4O2S — CID 61175854

IUPAC2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1-n1ccc(N)n1
InChIInChI=1S/C11H14N4O2S/c1-2-13-18(16,17)10-6-4-3-5-9(10)15-8-7-11(12)14-15/h3-8,13H,2H2,1H3,(H2,12,14)
InChIKeyHMUBUEPIGCJVPE-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.75
Rot. Bonds4

About 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide

2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide (PubChem CID 61175854) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide
PubChem CID61175854
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1-n1ccc(N)n1
InChIInChI=1S/C11H14N4O2S/c1-2-13-18(16,17)10-6-4-3-5-9(10)15-8-7-11(12)14-15/h3-8,13H,2H2,1H3,(H2,12,14)
InChIKeyHMUBUEPIGCJVPE-UHFFFAOYSA-N
XLogP0.75
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide 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-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide (CID 61175854) is 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide is CCNS(=O)(=O)c1ccccc1-n1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide?
The InChIKey is HMUBUEPIGCJVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-2-13-18(16,17)10-6-4-3-5-9(10)15-8-7-11(12)14-15/h3-8,13H,2H2,1H3,(H2,12,14).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide?
2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide has a molecular weight of 266.33 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-ethylbenzenesulfonamide is sourced from PubChem (CID 61175854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).