5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide

C15H12N4O3S — CID 136665583

IUPAC5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(O)c(/N=N/c3ccccn3)ccc2c1
InChIInChI=1S/C15H12N4O3S/c16-23(21,22)11-5-6-12-10(9-11)4-7-13(15(12)20)18-19-14-3-1-2-8-17-14/h1-9,20H,(H2,16,21,22)/b19-18+
InChIKeyVYKBEMMJNCKZTK-VHEBQXMUSA-N
MW328.35 g/mol
LogP3.00
Rot. Bonds3

About 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide

5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide (PubChem CID 136665583) has the molecular formula C15H12N4O3S and a molecular weight of 328.35 g/mol. Its IUPAC name is 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound Name5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide
PubChem CID136665583
Molecular FormulaC15H12N4O3S
Molecular Weight328.35 g/mol
Exact Mass328.06
IUPAC Name5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(O)c(/N=N/c3ccccn3)ccc2c1
InChIInChI=1S/C15H12N4O3S/c16-23(21,22)11-5-6-12-10(9-11)4-7-13(15(12)20)18-19-14-3-1-2-8-17-14/h1-9,20H,(H2,16,21,22)/b19-18+
InChIKeyVYKBEMMJNCKZTK-VHEBQXMUSA-N
XLogP3.00
TPSA118.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide?
The IUPAC name of 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide (CID 136665583) is 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide.
What is the SMILES notation for 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide?
The canonical SMILES for 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide is NS(=O)(=O)c1ccc2c(O)c(/N=N/c3ccccn3)ccc2c1.
What is the InChIKey of 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide?
The InChIKey is VYKBEMMJNCKZTK-VHEBQXMUSA-N. The full InChI is InChI=1S/C15H12N4O3S/c16-23(21,22)11-5-6-12-10(9-11)4-7-13(15(12)20)18-19-14-3-1-2-8-17-14/h1-9,20H,(H2,16,21,22)/b19-18+.
What are the key properties of 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide?
5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide has a molecular weight of 328.35 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-6-(pyridin-2-yldiazenyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 136665583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).