4-hydroxy-3-methylbenzenesulfonamide

C7H9NO3S — CID 57108308

IUPAC4-hydroxy-3-methylbenzenesulfonamide
SMILESCc1cc(S(N)(=O)=O)ccc1O
InChIInChI=1S/C7H9NO3S/c1-5-4-6(12(8,10)11)2-3-7(5)9/h2-4,9H,1H3,(H2,8,10,11)
InChIKeyVIHOWVWWGHBTIE-UHFFFAOYSA-N
MW187.22 g/mol
LogP0.35
Rot. Bonds1

About 4-hydroxy-3-methylbenzenesulfonamide

4-hydroxy-3-methylbenzenesulfonamide (PubChem CID 57108308) has the molecular formula C7H9NO3S and a molecular weight of 187.22 g/mol. Its IUPAC name is 4-hydroxy-3-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-hydroxy-3-methylbenzenesulfonamide
PubChem CID57108308
Molecular FormulaC7H9NO3S
Molecular Weight187.22 g/mol
Exact Mass187.03
IUPAC Name4-hydroxy-3-methylbenzenesulfonamide
SMILESCc1cc(S(N)(=O)=O)ccc1O
InChIInChI=1S/C7H9NO3S/c1-5-4-6(12(8,10)11)2-3-7(5)9/h2-4,9H,1H3,(H2,8,10,11)
InChIKeyVIHOWVWWGHBTIE-UHFFFAOYSA-N
XLogP0.35
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

silver 4-hydroxy-3-methylbenzenesulfonate
CID 174992481
4-(3,4-dimethylphenyl)sulfonyl-2-methylphenol
CID 20719205
4-(2-hydroxyphenyl)sulfonyl-2-methylphenol
CID 101301578
3-(4-hydroxy-3-methylphenyl)sulfonyl-4,5-dimethylphenol
CID 101301893
ethyl 2-hydroxy-5-sulfamoylbenzoate
CID 21312229
2-methyl-4-piperidin-1-ylsulfonylphenol
CID 138059728
4-hydroxy-3-[(4-methylphenyl)sulfonylamino]benzenesulfonamide
CID 169373397
formyl 2-methyl-4-sulfamoylbenzoate
CID 155177337
4-(methoxymethyl)-3-methylbenzenesulfonamide
CID 83271766
2-hydroxy-5-sulfamoylbenzenediazonium chloride
CID 14534997
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
1,1,3,3-tetramethyl-2-[(2-methyl-4-sulfamoylphenyl)methyl]guanidine
CID 122082186

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methylbenzenesulfonamide?
The IUPAC name of 4-hydroxy-3-methylbenzenesulfonamide (CID 57108308) is 4-hydroxy-3-methylbenzenesulfonamide.
What is the SMILES notation for 4-hydroxy-3-methylbenzenesulfonamide?
The canonical SMILES for 4-hydroxy-3-methylbenzenesulfonamide is Cc1cc(S(N)(=O)=O)ccc1O.
What is the InChIKey of 4-hydroxy-3-methylbenzenesulfonamide?
The InChIKey is VIHOWVWWGHBTIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO3S/c1-5-4-6(12(8,10)11)2-3-7(5)9/h2-4,9H,1H3,(H2,8,10,11).
What are the key properties of 4-hydroxy-3-methylbenzenesulfonamide?
4-hydroxy-3-methylbenzenesulfonamide has a molecular weight of 187.22 g/mol, XLogP of 0.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methylbenzenesulfonamide is sourced from PubChem (CID 57108308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).