2-amino-3-hydroxybenzenesulfonamide

C6H8N2O3S — CID 18949480

IUPAC2-amino-3-hydroxybenzenesulfonamide
SMILESNc1c(O)cccc1S(N)(=O)=O
InChIInChI=1S/C6H8N2O3S/c7-6-4(9)2-1-3-5(6)12(8,10)11/h1-3,9H,7H2,(H2,8,10,11)
InChIKeyONLRYPLDOJHXME-UHFFFAOYSA-N
MW188.21 g/mol
LogP-0.38
Rot. Bonds1

About 2-amino-3-hydroxybenzenesulfonamide

2-amino-3-hydroxybenzenesulfonamide (PubChem CID 18949480) has the molecular formula C6H8N2O3S and a molecular weight of 188.21 g/mol. Its IUPAC name is 2-amino-3-hydroxybenzenesulfonamide.

Molecular Properties

Compound Name2-amino-3-hydroxybenzenesulfonamide
PubChem CID18949480
Molecular FormulaC6H8N2O3S
Molecular Weight188.21 g/mol
Exact Mass188.03
IUPAC Name2-amino-3-hydroxybenzenesulfonamide
SMILESNc1c(O)cccc1S(N)(=O)=O
InChIInChI=1S/C6H8N2O3S/c7-6-4(9)2-1-3-5(6)12(8,10)11/h1-3,9H,7H2,(H2,8,10,11)
InChIKeyONLRYPLDOJHXME-UHFFFAOYSA-N
XLogP-0.38
TPSA106.41 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.21
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxybenzenesulfonamide?
The IUPAC name of 2-amino-3-hydroxybenzenesulfonamide (CID 18949480) is 2-amino-3-hydroxybenzenesulfonamide.
What is the SMILES notation for 2-amino-3-hydroxybenzenesulfonamide?
The canonical SMILES for 2-amino-3-hydroxybenzenesulfonamide is Nc1c(O)cccc1S(N)(=O)=O.
What is the InChIKey of 2-amino-3-hydroxybenzenesulfonamide?
The InChIKey is ONLRYPLDOJHXME-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3S/c7-6-4(9)2-1-3-5(6)12(8,10)11/h1-3,9H,7H2,(H2,8,10,11).
What are the key properties of 2-amino-3-hydroxybenzenesulfonamide?
2-amino-3-hydroxybenzenesulfonamide has a molecular weight of 188.21 g/mol, XLogP of -0.38, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxybenzenesulfonamide is sourced from PubChem (CID 18949480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).