4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide

C14H16N2O3S — CID 175398459

IUPAC4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(Nc2ccccc2CCO)cc1
InChIInChI=1S/C14H16N2O3S/c15-20(18,19)13-7-5-12(6-8-13)16-14-4-2-1-3-11(14)9-10-17/h1-8,16-17H,9-10H2,(H2,15,18,19)
InChIKeyNZZFUUBHQWLGOV-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.61
Rot. Bonds5

About 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide

4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide (PubChem CID 175398459) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide.

Molecular Properties

Compound Name4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide
PubChem CID175398459
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(Nc2ccccc2CCO)cc1
InChIInChI=1S/C14H16N2O3S/c15-20(18,19)13-7-5-12(6-8-13)16-14-4-2-1-3-11(14)9-10-17/h1-8,16-17H,9-10H2,(H2,15,18,19)
InChIKeyNZZFUUBHQWLGOV-UHFFFAOYSA-N
XLogP1.61
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[2-(4-methylanilino)phenyl]acetyl]benzenesulfonamide
CID 58317769
2-[2-(2-hydroxyethyl)anilino]benzoic acid
CID 10956213
2-(aminomethyl)-N-(4-ethylsulfonylphenyl)aniline
CID 63759186
N-[2-(2-hydroxyethyl)phenyl]methanesulfonamide
CID 117306913
2-(2-hydroxyphenyl)-N-(4-sulfamoylphenyl)acetamide
CID 80723230
4-(2-hydroxyethylsulfonylamino)benzenesulfonamide
CID 79026491
4-[2-[(E)-2-cyanoethenyl]anilino]benzenesulfonamide
CID 25110543
1-(2-iodophenyl)-3-(4-sulfamoylphenyl)urea
CID 68630610
2-[2-(sulfanylamino)phenyl]ethanol
CID 88722415
2-(chloromethyl)-N-[4-(difluoromethylsulfonyl)phenyl]aniline
CID 65027168
2-[2-(aminomethyl)anilino]benzenesulfonamide
CID 63761931
4-(2-naphthalen-1-ylhydrazinyl)benzenesulfonamide
CID 70469437

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide?
The IUPAC name of 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide (CID 175398459) is 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide.
What is the SMILES notation for 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide?
The canonical SMILES for 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide is NS(=O)(=O)c1ccc(Nc2ccccc2CCO)cc1.
What is the InChIKey of 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide?
The InChIKey is NZZFUUBHQWLGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c15-20(18,19)13-7-5-12(6-8-13)16-14-4-2-1-3-11(14)9-10-17/h1-8,16-17H,9-10H2,(H2,15,18,19).
What are the key properties of 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide?
4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.61, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-hydroxyethyl)anilino]benzenesulfonamide is sourced from PubChem (CID 175398459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).