4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide

C10H15FN2O3S — CID 82921210

IUPAC4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide
SMILESCN(C)CCOc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C10H15FN2O3S/c1-13(2)5-6-16-10-4-3-8(7-9(10)11)17(12,14)15/h3-4,7H,5-6H2,1-2H3,(H2,12,14,15)
InChIKeyXREOAXCYTGVAIN-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.41
Rot. Bonds5

About 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide

4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide (PubChem CID 82921210) has the molecular formula C10H15FN2O3S and a molecular weight of 262.31 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide
PubChem CID82921210
Molecular FormulaC10H15FN2O3S
Molecular Weight262.31 g/mol
Exact Mass262.08
IUPAC Name4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide
SMILESCN(C)CCOc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C10H15FN2O3S/c1-13(2)5-6-16-10-4-3-8(7-9(10)11)17(12,14)15/h3-4,7H,5-6H2,1-2H3,(H2,12,14,15)
InChIKeyXREOAXCYTGVAIN-UHFFFAOYSA-N
XLogP0.41
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

3-fluoro-4-(3-fluoropropoxy)benzenesulfonamide
CID 81113749
4-ethoxy-3-fluorobenzenesulfonamide
CID 43164444
4-(2-ethoxyethoxy)-3-fluorobenzenesulfonamide
CID 43457341
3-fluoro-4-octoxybenzenesulfonamide
CID 43342399
3-fluoro-4-(2-propan-2-yloxyethoxy)benzenesulfonamide
CID 61485134
2-cyclopropyl-N-[2-(2-fluoro-4-sulfamoylphenoxy)ethyl]-N-methylpropanamide
CID 126815373
4-[2-(dimethylamino)ethoxy]benzenesulfonamide
CID 22244704
3-fluoro-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzenesulfonamide
CID 82913717
2-[4-(aminomethyl)-2-fluorophenoxy]-N,N-dimethylethanamine
CID 61101901
3-fluoro-4-(3-methylbut-2-enoxy)benzenesulfonamide
CID 82921786
[4-[2-(dimethylamino)ethoxy]-3-fluorophenyl]methanol
CID 107690943
4-[2-(dimethylamino)ethoxy]-3-fluorobenzenecarbothioamide
CID 61102663

Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide?
The IUPAC name of 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide (CID 82921210) is 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide.
What is the SMILES notation for 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide?
The canonical SMILES for 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide is CN(C)CCOc1ccc(S(N)(=O)=O)cc1F.
What is the InChIKey of 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide?
The InChIKey is XREOAXCYTGVAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O3S/c1-13(2)5-6-16-10-4-3-8(7-9(10)11)17(12,14)15/h3-4,7H,5-6H2,1-2H3,(H2,12,14,15).
What are the key properties of 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide?
4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide has a molecular weight of 262.31 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethoxy]-3-fluorobenzenesulfonamide is sourced from PubChem (CID 82921210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).