4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide

C13H13NO4S — CID 2324622

IUPAC4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C13H13NO4S/c1-18-13-5-3-2-4-12(13)14-19(16,17)11-8-6-10(15)7-9-11/h2-9,14-15H,1H3
InChIKeyMCCLGBHUZSURJA-UHFFFAOYSA-N
MW279.32 g/mol
LogP2.20
Rot. Bonds4

About 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide

4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide (PubChem CID 2324622) has the molecular formula C13H13NO4S and a molecular weight of 279.32 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide
PubChem CID2324622
Molecular FormulaC13H13NO4S
Molecular Weight279.32 g/mol
Exact Mass279.06
IUPAC Name4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C13H13NO4S/c1-18-13-5-3-2-4-12(13)14-19(16,17)11-8-6-10(15)7-9-11/h2-9,14-15H,1H3
InChIKeyMCCLGBHUZSURJA-UHFFFAOYSA-N
XLogP2.20
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-methoxyphenyl)benzene-1-sulfonamide
CID 579335
Benzenesulfonamide, 3-amino-N,N-diethyl-4-methoxy-
CID 66804
N-(2-phenoxyphenyl)methanesulphonamide
CID 103958
Benzenesulfonamide, 3-amino-N-butyl-4-methoxy-
CID 66455
4-Chloro-2'-methoxybenzenesulfonanilide
CID 310128
4-methoxy-N-phenylbenzenesulfonamide
CID 835273
N-(4-Methoxyphenyl)benzenesulfonamide
CID 345790
4-amino-N-(4-methoxyphenyl)benzene-1-sulfonamide
CID 578975
Benzenesulfonic acid, 3-amino-4-methoxy-
CID 66821
3-amino-N-hydroxy-4-methoxybenzene-1-sulfonamide
CID 23645546
3-Amino-4-methoxyphenylsulphonyl fluoride
CID 96952
3-Amino-N-(4-methoxyphenyl)benzenesulfonamide
CID 2756466

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide?
The IUPAC name of 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide (CID 2324622) is 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide is COc1ccccc1NS(=O)(=O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide?
The InChIKey is MCCLGBHUZSURJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO4S/c1-18-13-5-3-2-4-12(13)14-19(16,17)11-8-6-10(15)7-9-11/h2-9,14-15H,1H3.
What are the key properties of 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide?
4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide has a molecular weight of 279.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 2324622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).