4-(2-pyridin-4-ylethoxy)benzenesulfonamide

C13H14N2O3S — CID 82910996

IUPAC4-(2-pyridin-4-ylethoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCCc2ccncc2)cc1
InChIInChI=1S/C13H14N2O3S/c14-19(16,17)13-3-1-12(2-4-13)18-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2,(H2,14,16,17)
InChIKeyPMINJUKKDYVHBI-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.35
Rot. Bonds5

About 4-(2-pyridin-4-ylethoxy)benzenesulfonamide

4-(2-pyridin-4-ylethoxy)benzenesulfonamide (PubChem CID 82910996) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 4-(2-pyridin-4-ylethoxy)benzenesulfonamide.

Molecular Properties

Compound Name4-(2-pyridin-4-ylethoxy)benzenesulfonamide
PubChem CID82910996
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name4-(2-pyridin-4-ylethoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCCc2ccncc2)cc1
InChIInChI=1S/C13H14N2O3S/c14-19(16,17)13-3-1-12(2-4-13)18-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2,(H2,14,16,17)
InChIKeyPMINJUKKDYVHBI-UHFFFAOYSA-N
XLogP1.35
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2-pyridin-4-ylethoxy)benzenesulfonamide 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

4-[2-(4-methylphenoxy)ethyl]pyridine
CID 64763978
2-amino-4-(3-pyridin-4-ylpropoxy)benzenesulfonamide
CID 79467347
2-[4-(2-pyridin-4-ylethoxy)phenyl]ethanethioamide
CID 60891304
2-[4-(2-pyridin-4-ylethoxy)phenyl]acetonitrile
CID 60890728
4-[2-(pyridin-4-ylmethylamino)ethyl]benzenesulfonamide;hydrochloride
CID 17292493
4-[2-(4-ethoxyphenyl)sulfonylethyl]pyridine
CID 3050823
4-[2-(dimethylamino)ethoxy]benzenesulfonamide
CID 22244704
4-(4-propoxyphenoxy)benzenesulfonamide
CID 43342703
4-(4-sulfamoylphenoxy)butanoic acid
CID 43164527
4-[(4-fluorophenyl)methoxy]benzenesulfonamide
CID 43342474
4-[(1S)-1-[methyl(2-pyridin-4-ylethyl)amino]ethyl]benzenesulfonamide
CID 35886705
4-amino-3-(2-pyridin-4-ylethylamino)benzenesulfonamide
CID 82907842

Frequently Asked Questions

What is the IUPAC name of 4-(2-pyridin-4-ylethoxy)benzenesulfonamide?
The IUPAC name of 4-(2-pyridin-4-ylethoxy)benzenesulfonamide (CID 82910996) is 4-(2-pyridin-4-ylethoxy)benzenesulfonamide.
What is the SMILES notation for 4-(2-pyridin-4-ylethoxy)benzenesulfonamide?
The canonical SMILES for 4-(2-pyridin-4-ylethoxy)benzenesulfonamide is NS(=O)(=O)c1ccc(OCCc2ccncc2)cc1.
What is the InChIKey of 4-(2-pyridin-4-ylethoxy)benzenesulfonamide?
The InChIKey is PMINJUKKDYVHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c14-19(16,17)13-3-1-12(2-4-13)18-10-7-11-5-8-15-9-6-11/h1-6,8-9H,7,10H2,(H2,14,16,17).
What are the key properties of 4-(2-pyridin-4-ylethoxy)benzenesulfonamide?
4-(2-pyridin-4-ylethoxy)benzenesulfonamide has a molecular weight of 278.33 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyridin-4-ylethoxy)benzenesulfonamide is sourced from PubChem (CID 82910996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).