4-ethoxybenzenesulfonamide

C8H11NO3S — CID 3724005

IUPAC4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C8H11NO3S/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)
InChIKeyILKGEOVHANZEFC-UHFFFAOYSA-N
MW201.25 g/mol
LogP0.73
Rot. Bonds3

About 4-ethoxybenzenesulfonamide

4-ethoxybenzenesulfonamide (PubChem CID 3724005) has the molecular formula C8H11NO3S and a molecular weight of 201.25 g/mol. Its IUPAC name is 4-ethoxybenzenesulfonamide.

Molecular Properties

Compound Name4-ethoxybenzenesulfonamide
PubChem CID3724005
Molecular FormulaC8H11NO3S
Molecular Weight201.25 g/mol
Exact Mass201.05
IUPAC Name4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C8H11NO3S/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11)
InChIKeyILKGEOVHANZEFC-UHFFFAOYSA-N
XLogP0.73
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethoxybenzenesulfonamide 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 4-ethoxybenzenesulfonamide?
The IUPAC name of 4-ethoxybenzenesulfonamide (CID 3724005) is 4-ethoxybenzenesulfonamide.
What is the SMILES notation for 4-ethoxybenzenesulfonamide?
The canonical SMILES for 4-ethoxybenzenesulfonamide is CCOc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 4-ethoxybenzenesulfonamide?
The InChIKey is ILKGEOVHANZEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3S/c1-2-12-7-3-5-8(6-4-7)13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11).
What are the key properties of 4-ethoxybenzenesulfonamide?
4-ethoxybenzenesulfonamide has a molecular weight of 201.25 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxybenzenesulfonamide is sourced from PubChem (CID 3724005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).