2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide

C12H13NO3S2 — CID 81241113

IUPAC2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
SMILESCN(Cc1ccsc1)S(=O)(=O)c1ccccc1O
InChIInChI=1S/C12H13NO3S2/c1-13(8-10-6-7-17-9-10)18(15,16)12-5-3-2-4-11(12)14/h2-7,9,14H,8H2,1H3
InChIKeyIMSLEOMJWQDAQC-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.27
Rot. Bonds4

About 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide

2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide (PubChem CID 81241113) has the molecular formula C12H13NO3S2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
PubChem CID81241113
Molecular FormulaC12H13NO3S2
Molecular Weight283.37 g/mol
Exact Mass283.03
IUPAC Name2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
SMILESCN(Cc1ccsc1)S(=O)(=O)c1ccccc1O
InChIInChI=1S/C12H13NO3S2/c1-13(8-10-6-7-17-9-10)18(15,16)12-5-3-2-4-11(12)14/h2-7,9,14H,8H2,1H3
InChIKeyIMSLEOMJWQDAQC-UHFFFAOYSA-N
XLogP2.27
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)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-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 43528520
N-methyl-2-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 62146077
4-fluoro-3-[methyl(thiophen-3-ylmethyl)sulfamoyl]benzoic acid
CID 43396637
4-amino-2-[methyl(thiophen-3-ylmethyl)sulfamoyl]benzoic acid
CID 102930944
3-bromo-4-[methyl(thiophen-3-ylmethyl)sulfamoyl]benzoic acid
CID 43528174
4-amino-2-chloro-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 43527986
2-methoxy-N,5-dimethyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 9190925
N-methyl-4-(methylamino)-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 43528516
3-(1-hydroxyethyl)-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 43528546
2-(aminomethyl)-5-fluoro-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 102920365
5-bromo-N,4-dimethyl-N-(thiophen-3-ylmethyl)thiophene-2-sulfonamide
CID 79932170
N-benzyl-5-hydroxy-N-methylnaphthalene-1-sulfonamide
CID 10215206

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide?
The IUPAC name of 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide (CID 81241113) is 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide is CN(Cc1ccsc1)S(=O)(=O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide?
The InChIKey is IMSLEOMJWQDAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3S2/c1-13(8-10-6-7-17-9-10)18(15,16)12-5-3-2-4-11(12)14/h2-7,9,14H,8H2,1H3.
What are the key properties of 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide?
2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide has a molecular weight of 283.37 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 81241113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).