N-(8-aminoquinolin-5-yl)benzenesulfonamide

C15H13N3O2S — CID 104826550

IUPACN-(8-aminoquinolin-5-yl)benzenesulfonamide
SMILESNc1ccc(NS(=O)(=O)c2ccccc2)c2cccnc12
InChIInChI=1S/C15H13N3O2S/c16-13-8-9-14(12-7-4-10-17-15(12)13)18-21(19,20)11-5-2-1-3-6-11/h1-10,18H,16H2
InChIKeyOAUKMQYLIAYYMP-UHFFFAOYSA-N
MW299.36 g/mol
LogP2.62
Rot. Bonds3

About N-(8-aminoquinolin-5-yl)benzenesulfonamide

N-(8-aminoquinolin-5-yl)benzenesulfonamide (PubChem CID 104826550) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is N-(8-aminoquinolin-5-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(8-aminoquinolin-5-yl)benzenesulfonamide
PubChem CID104826550
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC NameN-(8-aminoquinolin-5-yl)benzenesulfonamide
SMILESNc1ccc(NS(=O)(=O)c2ccccc2)c2cccnc12
InChIInChI=1S/C15H13N3O2S/c16-13-8-9-14(12-7-4-10-17-15(12)13)18-21(19,20)11-5-2-1-3-6-11/h1-10,18H,16H2
InChIKeyOAUKMQYLIAYYMP-UHFFFAOYSA-N
XLogP2.62
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(8-aminoquinolin-5-yl)-5-methylthiophene-2-sulfonamide
CID 104826570
N-benzo[h]quinolin-4-ylbenzenesulfonamide
CID 46307991
5-N-(propylsulfamoyl)quinoline-5,8-diamine
CID 114804992
4-chloro-N-(8-hydroxyquinolin-5-yl)benzenesulfonamide
CID 2318680
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
N-(8-aminoquinolin-5-yl)-2-propan-2-yloxyethanesulfonamide
CID 104826554
N-(8-aminoquinolin-5-yl)pyridine-2-carboxamide
CID 104826471
5-N-(2-iodophenyl)quinoline-5,8-diamine
CID 43449502
N-[5-[(2,5-dichlorophenyl)diazenyl]quinolin-8-yl]benzenesulfonamide
CID 91717870
N-(5-bromoquinolin-8-yl)-4-methylbenzenesulfonamide
CID 1380885
N-(6-amino-1,10-phenanthrolin-5-yl)-4-methylbenzenesulfonamide
CID 102264141
5-N-(2,3-dihydro-1H-inden-2-yl)quinoline-5,8-diamine
CID 107844436

Frequently Asked Questions

What is the IUPAC name of N-(8-aminoquinolin-5-yl)benzenesulfonamide?
The IUPAC name of N-(8-aminoquinolin-5-yl)benzenesulfonamide (CID 104826550) is N-(8-aminoquinolin-5-yl)benzenesulfonamide.
What is the SMILES notation for N-(8-aminoquinolin-5-yl)benzenesulfonamide?
The canonical SMILES for N-(8-aminoquinolin-5-yl)benzenesulfonamide is Nc1ccc(NS(=O)(=O)c2ccccc2)c2cccnc12.
What is the InChIKey of N-(8-aminoquinolin-5-yl)benzenesulfonamide?
The InChIKey is OAUKMQYLIAYYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c16-13-8-9-14(12-7-4-10-17-15(12)13)18-21(19,20)11-5-2-1-3-6-11/h1-10,18H,16H2.
What are the key properties of N-(8-aminoquinolin-5-yl)benzenesulfonamide?
N-(8-aminoquinolin-5-yl)benzenesulfonamide has a molecular weight of 299.36 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-aminoquinolin-5-yl)benzenesulfonamide is sourced from PubChem (CID 104826550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).