2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide

C18H20N2O4S — CID 16826959

IUPAC2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C18H20N2O4S/c1-12-4-8-16(24-3)17(10-12)25(22,23)19-14-6-7-15-13(11-14)5-9-18(21)20(15)2/h4,6-8,10-11,19H,5,9H2,1-3H3
InChIKeyLHUOZURANJXTQD-UHFFFAOYSA-N
MW360.44 g/mol
LogP2.71
Rot. Bonds4

About 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide

2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide (PubChem CID 16826959) has the molecular formula C18H20N2O4S and a molecular weight of 360.44 g/mol. Its IUPAC name is 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide
PubChem CID16826959
Molecular FormulaC18H20N2O4S
Molecular Weight360.44 g/mol
Exact Mass360.11
IUPAC Name2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2C
InChIInChI=1S/C18H20N2O4S/c1-12-4-8-16(24-3)17(10-12)25(22,23)19-14-6-7-15-13(11-14)5-9-18(21)20(15)2/h4,6-8,10-11,19H,5,9H2,1-3H3
InChIKeyLHUOZURANJXTQD-UHFFFAOYSA-N
XLogP2.71
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-5-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635810
2,5-dimethoxy-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)benzenesulfonamide
CID 16828141
5-chloro-2-methoxy-N-[1-(2-methoxyethyl)-2-oxo-3,4-dihydroquinolin-6-yl]benzenesulfonamide
CID 30532854
2,3,5,6-tetramethyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide
CID 20933603
N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)methanesulfonamide
CID 16820558
2-methoxy-4,5-dimethyl-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]benzenesulfonamide
CID 16927648
1,6-dimethyl-3,4-dihydroquinolin-2-one
CID 20546933
2-methoxy-5-methyl-N-(3-methylphenyl)benzenesulfonamide
CID 967885
5-fluoro-2-methoxy-N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide
CID 43955848
N-(1-ethyl-2-oxo-3,4-dihydroquinolin-6-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 20933581
N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]-2,5-dimethylbenzenesulfonamide
CID 7636428
N-[1-(2-methoxyethyl)-2-oxo-3,4-dihydroquinolin-6-yl]-3,5-dimethylbenzenesulfonamide
CID 71842856

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide?
The IUPAC name of 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide (CID 16826959) is 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide.
What is the SMILES notation for 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide?
The canonical SMILES for 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide is COc1ccc(C)cc1S(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2C.
What is the InChIKey of 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide?
The InChIKey is LHUOZURANJXTQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4S/c1-12-4-8-16(24-3)17(10-12)25(22,23)19-14-6-7-15-13(11-14)5-9-18(21)20(15)2/h4,6-8,10-11,19H,5,9H2,1-3H3.
What are the key properties of 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide?
2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide has a molecular weight of 360.44 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-N-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)benzenesulfonamide is sourced from PubChem (CID 16826959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).