azane;2-cyano-5-hydroxybenzenesulfonamide

C7H9N3O3S — CID 174596934

IUPACazane;2-cyano-5-hydroxybenzenesulfonamide
SMILESN.N#Cc1ccc(O)cc1S(N)(=O)=O
InChIInChI=1S/C7H6N2O3S.H3N/c8-4-5-1-2-6(10)3-7(5)13(9,11)12;/h1-3,10H,(H2,9,11,12);1H3
InChIKeyBFTAZPBUZKYNAY-UHFFFAOYSA-N
MW215.23 g/mol
LogP0.07
Rot. Bonds1

About azane;2-cyano-5-hydroxybenzenesulfonamide

azane;2-cyano-5-hydroxybenzenesulfonamide (PubChem CID 174596934) has the molecular formula C7H9N3O3S and a molecular weight of 215.23 g/mol. Its IUPAC name is azane;2-cyano-5-hydroxybenzenesulfonamide.

Molecular Properties

Compound Nameazane;2-cyano-5-hydroxybenzenesulfonamide
PubChem CID174596934
Molecular FormulaC7H9N3O3S
Molecular Weight215.23 g/mol
Exact Mass215.04
IUPAC Nameazane;2-cyano-5-hydroxybenzenesulfonamide
SMILESN.N#Cc1ccc(O)cc1S(N)(=O)=O
InChIInChI=1S/C7H6N2O3S.H3N/c8-4-5-1-2-6(10)3-7(5)13(9,11)12;/h1-3,10H,(H2,9,11,12);1H3
InChIKeyBFTAZPBUZKYNAY-UHFFFAOYSA-N
XLogP0.07
TPSA139.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of azane;2-cyano-5-hydroxybenzenesulfonamide?
The IUPAC name of azane;2-cyano-5-hydroxybenzenesulfonamide (CID 174596934) is azane;2-cyano-5-hydroxybenzenesulfonamide.
What is the SMILES notation for azane;2-cyano-5-hydroxybenzenesulfonamide?
The canonical SMILES for azane;2-cyano-5-hydroxybenzenesulfonamide is N.N#Cc1ccc(O)cc1S(N)(=O)=O.
What is the InChIKey of azane;2-cyano-5-hydroxybenzenesulfonamide?
The InChIKey is BFTAZPBUZKYNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O3S.H3N/c8-4-5-1-2-6(10)3-7(5)13(9,11)12;/h1-3,10H,(H2,9,11,12);1H3.
What are the key properties of azane;2-cyano-5-hydroxybenzenesulfonamide?
azane;2-cyano-5-hydroxybenzenesulfonamide has a molecular weight of 215.23 g/mol, XLogP of 0.07, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-cyano-5-hydroxybenzenesulfonamide is sourced from PubChem (CID 174596934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).