2-hydroxy-3,4-dimethoxybenzenesulfonamide

C8H11NO5S — CID 174958358

IUPAC2-hydroxy-3,4-dimethoxybenzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)c(O)c1OC
InChIInChI=1S/C8H11NO5S/c1-13-5-3-4-6(15(9,11)12)7(10)8(5)14-2/h3-4,10H,1-2H3,(H2,9,11,12)
InChIKeyQVURRRHCNVMIGU-UHFFFAOYSA-N
MW233.24 g/mol
LogP0.06
Rot. Bonds3

About 2-hydroxy-3,4-dimethoxybenzenesulfonamide

2-hydroxy-3,4-dimethoxybenzenesulfonamide (PubChem CID 174958358) has the molecular formula C8H11NO5S and a molecular weight of 233.24 g/mol. Its IUPAC name is 2-hydroxy-3,4-dimethoxybenzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-3,4-dimethoxybenzenesulfonamide
PubChem CID174958358
Molecular FormulaC8H11NO5S
Molecular Weight233.24 g/mol
Exact Mass233.04
IUPAC Name2-hydroxy-3,4-dimethoxybenzenesulfonamide
SMILESCOc1ccc(S(N)(=O)=O)c(O)c1OC
InChIInChI=1S/C8H11NO5S/c1-13-5-3-4-6(15(9,11)12)7(10)8(5)14-2/h3-4,10H,1-2H3,(H2,9,11,12)
InChIKeyQVURRRHCNVMIGU-UHFFFAOYSA-N
XLogP0.06
TPSA98.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-hydroxy-3,4-dimethoxybenzenesulfonamide 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

2,3-dimethoxybenzenesulfonamide;hydrochloride
CID 142896136
butyl 2,6-dimethoxy-3-sulfamoylbenzoate
CID 65379600
2-chloro-3,4-dimethoxybenzenesulfonic acid
CID 140533382
2-methoxy-4-(2-oxopropyl)benzenesulfonamide
CID 163498161
N-(cyclopropylmethyl)-2,6-dimethoxy-3-sulfamoylbenzamide
CID 65374073
4-bromo-2-methoxybenzenesulfonamide
CID 21129172
2-hydroxy-3-methoxy-4-methylbenzenesulfonic acid
CID 21026705
(2S)-2-amino-2-(2-hydroxy-3,4-dimethoxyphenyl)acetic acid
CID 66513090
3-(2-hydroxy-3,4-dimethoxyphenyl)propanoic acid
CID 117325047
2-fluoro-3,4-dimethoxybenzenesulfonyl chloride
CID 84708317
6-(1-aminocyclopropyl)-2,3-dimethoxyphenol
CID 117298428
2-methoxy-4,5-dimethylbenzenesulfonamide
CID 27241719

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3,4-dimethoxybenzenesulfonamide?
The IUPAC name of 2-hydroxy-3,4-dimethoxybenzenesulfonamide (CID 174958358) is 2-hydroxy-3,4-dimethoxybenzenesulfonamide.
What is the SMILES notation for 2-hydroxy-3,4-dimethoxybenzenesulfonamide?
The canonical SMILES for 2-hydroxy-3,4-dimethoxybenzenesulfonamide is COc1ccc(S(N)(=O)=O)c(O)c1OC.
What is the InChIKey of 2-hydroxy-3,4-dimethoxybenzenesulfonamide?
The InChIKey is QVURRRHCNVMIGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO5S/c1-13-5-3-4-6(15(9,11)12)7(10)8(5)14-2/h3-4,10H,1-2H3,(H2,9,11,12).
What are the key properties of 2-hydroxy-3,4-dimethoxybenzenesulfonamide?
2-hydroxy-3,4-dimethoxybenzenesulfonamide has a molecular weight of 233.24 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3,4-dimethoxybenzenesulfonamide is sourced from PubChem (CID 174958358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).