N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide

C16H14N2O3S — CID 22674101

IUPACN-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cnc3c(O)cccc3c2)cc1
InChIInChI=1S/C16H14N2O3S/c1-11-5-7-14(8-6-11)22(20,21)18-13-9-12-3-2-4-15(19)16(12)17-10-13/h2-10,18-19H,1H3
InChIKeyNLKFISZYVMETOM-UHFFFAOYSA-N
MW314.37 g/mol
LogP3.05
Rot. Bonds3

About N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide

N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide (PubChem CID 22674101) has the molecular formula C16H14N2O3S and a molecular weight of 314.37 g/mol. Its IUPAC name is N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide
PubChem CID22674101
Molecular FormulaC16H14N2O3S
Molecular Weight314.37 g/mol
Exact Mass314.07
IUPAC NameN-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cnc3c(O)cccc3c2)cc1
InChIInChI=1S/C16H14N2O3S/c1-11-5-7-14(8-6-11)22(20,21)18-13-9-12-3-2-4-15(19)16(12)17-10-13/h2-10,18-19H,1H3
InChIKeyNLKFISZYVMETOM-UHFFFAOYSA-N
XLogP3.05
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(8-bromoquinolin-3-yl)-4-isocyanobenzenesulfonamide
CID 59083357
3-(4-methylphenyl)quinolin-8-ol
CID 134530659
4-methyl-N-(6-methyl-3-pyridinyl)benzenesulfonamide
CID 84581619
ethane;3-methylquinolin-8-ol
CID 143422090
ethane;N-quinolin-3-ylbenzenesulfonamide
CID 90950237
4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
4-methyl-N-(3-quinolin-3-ylphenyl)benzenesulfonamide
CID 169371631
4-hydroxy-5-[(4-methylphenyl)sulfonylamino]naphthalene-2-sulfonic acid
CID 129188390
N-[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide
CID 70133555
4-hydroxy-N-(5-methyl-3-pyridinyl)benzenesulfonamide
CID 107585953
3-[(E)-2-(4-methylphenyl)ethenyl]quinolin-8-ol
CID 134530665
N-(7-fluoronaphthalen-2-yl)-4-methylbenzenesulfonamide
CID 132500915

Frequently Asked Questions

What is the IUPAC name of N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide?
The IUPAC name of N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide (CID 22674101) is N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide.
What is the SMILES notation for N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide?
The canonical SMILES for N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2cnc3c(O)cccc3c2)cc1.
What is the InChIKey of N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide?
The InChIKey is NLKFISZYVMETOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S/c1-11-5-7-14(8-6-11)22(20,21)18-13-9-12-3-2-4-15(19)16(12)17-10-13/h2-10,18-19H,1H3.
What are the key properties of N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide?
N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide has a molecular weight of 314.37 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide is sourced from PubChem (CID 22674101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).