N-(2-methylquinolin-8-yl)benzenesulfonamide

C16H14N2O2S — CID 2848041

IUPACN-(2-methylquinolin-8-yl)benzenesulfonamide
SMILESCc1ccc2cccc(NS(=O)(=O)c3ccccc3)c2n1
InChIInChI=1S/C16H14N2O2S/c1-12-10-11-13-6-5-9-15(16(13)17-12)18-21(19,20)14-7-3-2-4-8-14/h2-11,18H,1H3
InChIKeyIXWWCFNPCYOVOT-UHFFFAOYSA-N
MW298.37 g/mol
LogP3.34
Rot. Bonds3

About N-(2-methylquinolin-8-yl)benzenesulfonamide

N-(2-methylquinolin-8-yl)benzenesulfonamide (PubChem CID 2848041) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(2-methylquinolin-8-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methylquinolin-8-yl)benzenesulfonamide
PubChem CID2848041
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC NameN-(2-methylquinolin-8-yl)benzenesulfonamide
SMILESCc1ccc2cccc(NS(=O)(=O)c3ccccc3)c2n1
InChIInChI=1S/C16H14N2O2S/c1-12-10-11-13-6-5-9-15(16(13)17-12)18-21(19,20)14-7-3-2-4-8-14/h2-11,18H,1H3
InChIKeyIXWWCFNPCYOVOT-UHFFFAOYSA-N
XLogP3.34
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylquinolin-8-yl)benzenesulfonamide?
The IUPAC name of N-(2-methylquinolin-8-yl)benzenesulfonamide (CID 2848041) is N-(2-methylquinolin-8-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-methylquinolin-8-yl)benzenesulfonamide?
The canonical SMILES for N-(2-methylquinolin-8-yl)benzenesulfonamide is Cc1ccc2cccc(NS(=O)(=O)c3ccccc3)c2n1.
What is the InChIKey of N-(2-methylquinolin-8-yl)benzenesulfonamide?
The InChIKey is IXWWCFNPCYOVOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c1-12-10-11-13-6-5-9-15(16(13)17-12)18-21(19,20)14-7-3-2-4-8-14/h2-11,18H,1H3.
What are the key properties of N-(2-methylquinolin-8-yl)benzenesulfonamide?
N-(2-methylquinolin-8-yl)benzenesulfonamide has a molecular weight of 298.37 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylquinolin-8-yl)benzenesulfonamide is sourced from PubChem (CID 2848041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).