6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide

C16H14N2O3S — CID 163888329

IUPAC6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide
SMILESNc1ccc2cc(S(=O)(=O)Nc3ccccc3)cc(O)c2c1
InChIInChI=1S/C16H14N2O3S/c17-12-7-6-11-8-14(10-16(19)15(11)9-12)22(20,21)18-13-4-2-1-3-5-13/h1-10,18-19H,17H2
InChIKeyPZJMXGCUMYSYGN-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.93
Rot. Bonds3

About 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide

6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide (PubChem CID 163888329) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide.

Molecular Properties

Compound Name6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide
PubChem CID163888329
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC Name6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide
SMILESNc1ccc2cc(S(=O)(=O)Nc3ccccc3)cc(O)c2c1
InChIInChI=1S/C16H14N2O3S/c17-12-7-6-11-8-14(10-16(19)15(11)9-12)22(20,21)18-13-4-2-1-3-5-13/h1-10,18-19H,17H2
InChIKeyPZJMXGCUMYSYGN-UHFFFAOYSA-N
XLogP2.93
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-4-hydroxynaphthalene-2-sulfonamide
CID 22766301
7-hydroxy-1-N,3-N-diphenylnaphthalene-1,3-disulfonamide
CID 1376755
3-amino-4-hydroxy-N-phenylbenzenesulfonamide;hydrochloride
CID 3018876
4-amino-2-(phenylsulfamoyl)benzoic acid
CID 102930725
5-hydroxy-6-oxo-N-phenyl-1H-pyridine-3-sulfonamide
CID 91700365
3-chloro-5-hydroxy-N-phenylbenzenesulfonamide
CID 70056195
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
7-amino-4-hydroxynaphthalene-2-sulfonate
CID 22096616
5-[[4-(benzenesulfonamido)phenyl]sulfamoyl]-2-hydroxybenzamide
CID 130406207
2-amino-N-phenylpyrimidine-5-sulfonamide
CID 46360874
N-[4-(4-aminophenyl)sulfanylphenyl]benzenesulfonamide
CID 3451294
3-amino-4-chloro-N-phenylbenzenesulfonamide
CID 2873180

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide?
The IUPAC name of 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide (CID 163888329) is 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide.
What is the SMILES notation for 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide?
The canonical SMILES for 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide is Nc1ccc2cc(S(=O)(=O)Nc3ccccc3)cc(O)c2c1.
What is the InChIKey of 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide?
The InChIKey is PZJMXGCUMYSYGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c17-12-7-6-11-8-14(10-16(19)15(11)9-12)22(20,21)18-13-4-2-1-3-5-13/h1-10,18-19H,17H2.
What are the key properties of 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide?
6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide has a molecular weight of 314.37 g/mol, XLogP of 2.93, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-hydroxy-N-phenylnaphthalene-2-sulfonamide is sourced from PubChem (CID 163888329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).