5-amino-2-hydroxy-N-methylbenzenesulfonamide

C7H10N2O3S — CID 75525559

IUPAC5-amino-2-hydroxy-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(N)ccc1O
InChIInChI=1S/C7H10N2O3S/c1-9-13(11,12)7-4-5(8)2-3-6(7)10/h2-4,9-10H,8H2,1H3
InChIKeyMFKFNHYTTUXTCT-UHFFFAOYSA-N
MW202.24 g/mol
LogP-0.12
Rot. Bonds2

About 5-amino-2-hydroxy-N-methylbenzenesulfonamide

5-amino-2-hydroxy-N-methylbenzenesulfonamide (PubChem CID 75525559) has the molecular formula C7H10N2O3S and a molecular weight of 202.24 g/mol. Its IUPAC name is 5-amino-2-hydroxy-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name5-amino-2-hydroxy-N-methylbenzenesulfonamide
PubChem CID75525559
Molecular FormulaC7H10N2O3S
Molecular Weight202.24 g/mol
Exact Mass202.04
IUPAC Name5-amino-2-hydroxy-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(N)ccc1O
InChIInChI=1S/C7H10N2O3S/c1-9-13(11,12)7-4-5(8)2-3-6(7)10/h2-4,9-10H,8H2,1H3
InChIKeyMFKFNHYTTUXTCT-UHFFFAOYSA-N
XLogP-0.12
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N,5-dimethylbenzenesulfonamide
CID 70460413
5-bromo-2-hydroxy-N-methylbenzenesulfonamide
CID 169108659
5-amino-2-bromo-N-methylbenzenesulfonamide
CID 65201802
5-acetyl-2-hydroxy-N-methylbenzenesulfonamide
CID 154481040
2-[(5-amino-2-hydroxyphenyl)methylamino]-N-methylbenzenesulfonamide
CID 60874920
5-amino-2-(2-hydroxypropylamino)-N-methylbenzenesulfonamide
CID 103286731
5-amino-2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-N-methylbenzenesulfonamide
CID 103287233
5-amino-2-[2-hydroxyethyl(methyl)amino]-N-methylbenzenesulfonamide
CID 103286700
5-amino-2-[(3-hydroxy-2-methylbutan-2-yl)amino]-N-methylbenzenesulfonamide
CID 103287457
5-amino-2-[(4-chlorophenyl)methylamino]-N-methylbenzenesulfonamide
CID 103286589
5-amino-2-[(4-fluorophenyl)methylamino]-N-methylbenzenesulfonamide
CID 103286616
5-amino-2-(4-hydroxy-4-methylpiperidin-1-yl)-N-methylbenzenesulfonamide
CID 103287216

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-hydroxy-N-methylbenzenesulfonamide?
The IUPAC name of 5-amino-2-hydroxy-N-methylbenzenesulfonamide (CID 75525559) is 5-amino-2-hydroxy-N-methylbenzenesulfonamide.
What is the SMILES notation for 5-amino-2-hydroxy-N-methylbenzenesulfonamide?
The canonical SMILES for 5-amino-2-hydroxy-N-methylbenzenesulfonamide is CNS(=O)(=O)c1cc(N)ccc1O.
What is the InChIKey of 5-amino-2-hydroxy-N-methylbenzenesulfonamide?
The InChIKey is MFKFNHYTTUXTCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3S/c1-9-13(11,12)7-4-5(8)2-3-6(7)10/h2-4,9-10H,8H2,1H3.
What are the key properties of 5-amino-2-hydroxy-N-methylbenzenesulfonamide?
5-amino-2-hydroxy-N-methylbenzenesulfonamide has a molecular weight of 202.24 g/mol, XLogP of -0.12, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-hydroxy-N-methylbenzenesulfonamide is sourced from PubChem (CID 75525559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).