N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide

C20H22N2O4S — CID 2985803

IUPACN-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
SMILESCOCCN(Cc1cc2ccc(C)cc2[nH]c1=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H22N2O4S/c1-15-8-9-16-13-17(20(23)21-19(16)12-15)14-22(10-11-26-2)27(24,25)18-6-4-3-5-7-18/h3-9,12-13H,10-11,14H2,1-2H3,(H,21,23)
InChIKeyCCGLLKFSOINILC-UHFFFAOYSA-N
MW386.47 g/mol
LogP2.67
Rot. Bonds7

About N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide

N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide (PubChem CID 2985803) has the molecular formula C20H22N2O4S and a molecular weight of 386.47 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
PubChem CID2985803
Molecular FormulaC20H22N2O4S
Molecular Weight386.47 g/mol
Exact Mass386.13
IUPAC NameN-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
SMILESCOCCN(Cc1cc2ccc(C)cc2[nH]c1=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H22N2O4S/c1-15-8-9-16-13-17(20(23)21-19(16)12-15)14-22(10-11-26-2)27(24,25)18-6-4-3-5-7-18/h3-9,12-13H,10-11,14H2,1-2H3,(H,21,23)
InChIKeyCCGLLKFSOINILC-UHFFFAOYSA-N
XLogP2.67
TPSA79.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.47
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide 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-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 2811587
(E)-N-(5-fluoro-2-methylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2485069
(E)-N-(3-acetamidophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 2489006
(E)-3-(4-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)prop-2-enamide
CID 6245900
4-methyl-6-(morpholin-4-ylsulfonyl)quinolin-2(1H)-one
CID 16832102
3-(diethylsulfamoyl)-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
CID 3240611
N-(1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 131985884
N-(7,8-Dimethyl-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-N-(2-hydroxy-ethyl)-4-methyl-benzenesulfonamide
CID 654828
N-ethyl-N-((2-hydroxyquinolin-3-yl)methyl)benzenesulfonamide
CID 665999
N-cyclohexyl-N-((2-hydroxyquinolin-3-yl)methyl)methanesulfonamide
CID 667282
4-(Morpholine-4-sulfonyl)-N-phenyl-benzamide
CID 777437
N~1~-(2,5-dimethylphenyl)-N~2~-(phenylsulfonyl)glycinamide
CID 891601

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide (CID 2985803) is N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide is COCCN(Cc1cc2ccc(C)cc2[nH]c1=O)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The InChIKey is CCGLLKFSOINILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4S/c1-15-8-9-16-13-17(20(23)21-19(16)12-15)14-22(10-11-26-2)27(24,25)18-6-4-3-5-7-18/h3-9,12-13H,10-11,14H2,1-2H3,(H,21,23).
What are the key properties of N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide has a molecular weight of 386.47 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide is sourced from PubChem (CID 2985803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).