4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide

C19H20N2O5S — CID 110324955

IUPAC4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCc2cc3cc(OC)ccc3[nH]c2=O)c(C)c1
InChIInChI=1S/C19H20N2O5S/c1-12-8-15(25-2)5-7-18(12)27(23,24)20-11-14-9-13-10-16(26-3)4-6-17(13)21-19(14)22/h4-10,20H,11H2,1-3H3,(H,21,22)
InChIKeyKPVWTIYGOSSAHU-UHFFFAOYSA-N
MW388.45 g/mol
LogP2.33
Rot. Bonds6

About 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide

4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide (PubChem CID 110324955) has the molecular formula C19H20N2O5S and a molecular weight of 388.45 g/mol. Its IUPAC name is 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide
PubChem CID110324955
Molecular FormulaC19H20N2O5S
Molecular Weight388.45 g/mol
Exact Mass388.11
IUPAC Name4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCc2cc3cc(OC)ccc3[nH]c2=O)c(C)c1
InChIInChI=1S/C19H20N2O5S/c1-12-8-15(25-2)5-7-18(12)27(23,24)20-11-14-9-13-10-16(26-3)4-6-17(13)21-19(14)22/h4-10,20H,11H2,1-3H3,(H,21,22)
InChIKeyKPVWTIYGOSSAHU-UHFFFAOYSA-N
XLogP2.33
TPSA97.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324686
5-ethyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiophene-2-sulfonamide
CID 110324960
4-methoxy-2-methyl-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzenesulfonamide
CID 110785308
2,4-dimethoxy-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324463
1-(2-chlorophenyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]methanesulfonamide
CID 110324969
3-[(4-fluoroanilino)methyl]-6-methoxy-1H-quinolin-2-one
CID 856495
6-methoxy-3-[(3-methylanilino)methyl]-1H-quinolin-2-one
CID 943158
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-4-methylbenzenesulfonamide
CID 110326072
N-[2-(6-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]propane-1-sulfonamide
CID 110326068
3-(hydroxymethyl)-6-methoxy-1H-quinolin-2-one
CID 865120
N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-4-methoxybenzenesulfonamide
CID 110325519
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
CID 110324860

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide (CID 110324955) is 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide is COc1ccc(S(=O)(=O)NCc2cc3cc(OC)ccc3[nH]c2=O)c(C)c1.
What is the InChIKey of 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide?
The InChIKey is KPVWTIYGOSSAHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5S/c1-12-8-15(25-2)5-7-18(12)27(23,24)20-11-14-9-13-10-16(26-3)4-6-17(13)21-19(14)22/h4-10,20H,11H2,1-3H3,(H,21,22).
What are the key properties of 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide?
4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide has a molecular weight of 388.45 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylbenzenesulfonamide is sourced from PubChem (CID 110324955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).