N-(4-hydroxyphenyl)quinoline-8-sulfonamide

C15H12N2O3S — CID 894115

IUPACN-(4-hydroxyphenyl)quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1)c1cccc2cccnc12
InChIInChI=1S/C15H12N2O3S/c18-13-8-6-12(7-9-13)17-21(19,20)14-5-1-3-11-4-2-10-16-15(11)14/h1-10,17-18H
InChIKeyKVFNSUPFXGYOKN-UHFFFAOYSA-N
MW300.34 g/mol
LogP2.74
Rot. Bonds3

About N-(4-hydroxyphenyl)quinoline-8-sulfonamide

N-(4-hydroxyphenyl)quinoline-8-sulfonamide (PubChem CID 894115) has the molecular formula C15H12N2O3S and a molecular weight of 300.34 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)quinoline-8-sulfonamide
PubChem CID894115
Molecular FormulaC15H12N2O3S
Molecular Weight300.34 g/mol
Exact Mass300.06
IUPAC NameN-(4-hydroxyphenyl)quinoline-8-sulfonamide
SMILESO=S(=O)(Nc1ccc(O)cc1)c1cccc2cccnc12
InChIInChI=1S/C15H12N2O3S/c18-13-8-6-12(7-9-13)17-21(19,20)14-5-1-3-11-4-2-10-16-15(11)14/h1-10,17-18H
InChIKeyKVFNSUPFXGYOKN-UHFFFAOYSA-N
XLogP2.74
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)quinoline-8-sulfonamide?
The IUPAC name of N-(4-hydroxyphenyl)quinoline-8-sulfonamide (CID 894115) is N-(4-hydroxyphenyl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(4-hydroxyphenyl)quinoline-8-sulfonamide?
The canonical SMILES for N-(4-hydroxyphenyl)quinoline-8-sulfonamide is O=S(=O)(Nc1ccc(O)cc1)c1cccc2cccnc12.
What is the InChIKey of N-(4-hydroxyphenyl)quinoline-8-sulfonamide?
The InChIKey is KVFNSUPFXGYOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3S/c18-13-8-6-12(7-9-13)17-21(19,20)14-5-1-3-11-4-2-10-16-15(11)14/h1-10,17-18H.
What are the key properties of N-(4-hydroxyphenyl)quinoline-8-sulfonamide?
N-(4-hydroxyphenyl)quinoline-8-sulfonamide has a molecular weight of 300.34 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)quinoline-8-sulfonamide is sourced from PubChem (CID 894115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).