4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide

C19H17N3O4S — CID 118918718

IUPAC4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide
SMILESCOc1cc2c(ccc(=O)n2C)cc1N(C)S(=O)(=O)c1ccc(C#N)cc1
InChIInChI=1S/C19H17N3O4S/c1-21-16-11-18(26-3)17(10-14(16)6-9-19(21)23)22(2)27(24,25)15-7-4-13(12-20)5-8-15/h4-11H,1-3H3
InChIKeyVJMFXYHNFZQGEM-UHFFFAOYSA-N
MW383.43 g/mol
LogP2.24
Rot. Bonds4

About 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide

4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide (PubChem CID 118918718) has the molecular formula C19H17N3O4S and a molecular weight of 383.43 g/mol. Its IUPAC name is 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide
PubChem CID118918718
Molecular FormulaC19H17N3O4S
Molecular Weight383.43 g/mol
Exact Mass383.09
IUPAC Name4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide
SMILESCOc1cc2c(ccc(=O)n2C)cc1N(C)S(=O)(=O)c1ccc(C#N)cc1
InChIInChI=1S/C19H17N3O4S/c1-21-16-11-18(26-3)17(10-14(16)6-9-19(21)23)22(2)27(24,25)15-7-4-13(12-20)5-8-15/h4-11H,1-3H3
InChIKeyVJMFXYHNFZQGEM-UHFFFAOYSA-N
XLogP2.24
TPSA92.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide with MolForge

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Related Compounds

NI-57
CID 91827373
4-Cyano-N-(7-Methoxy-1,4-Dimethyl-2-Oxo-1,2-Dihydroquinolin-6-Yl)benzene-1-Sulfonamide
CID 118933136
4-cyano-N-(3-ethyl-1-methyl-2-oxoquinolin-6-yl)-2-methoxybenzenesulfonamide
CID 118918689
4-cyano-2-methoxy-N-(7-methoxy-1,3-dimethyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118918705
4-cyano-N-(1-methyl-2-oxo-7-propan-2-yloxyquinolin-6-yl)benzenesulfonamide
CID 118918747
4-cyano-N-(7-ethoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118918749
4-cyano-N-(1,3-dimethyl-2-oxoquinolin-6-yl)-2-methoxy-N-methylbenzenesulfonamide
CID 118918753
4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118932975
N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118932979
4-cyano-N-(7-methoxy-1,3-dimethyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118933133
N-(7-methoxy-1,3-dimethyl-2-oxoquinolin-6-yl)benzenesulfonamide
CID 118933134
4-cyano-N-(1,3-diethyl-2-oxoquinolin-6-yl)-2-methoxybenzenesulfonamide
CID 137632687

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide?
The IUPAC name of 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide (CID 118918718) is 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide.
What is the SMILES notation for 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide?
The canonical SMILES for 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide is COc1cc2c(ccc(=O)n2C)cc1N(C)S(=O)(=O)c1ccc(C#N)cc1.
What is the InChIKey of 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide?
The InChIKey is VJMFXYHNFZQGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4S/c1-21-16-11-18(26-3)17(10-14(16)6-9-19(21)23)22(2)27(24,25)15-7-4-13(12-20)5-8-15/h4-11H,1-3H3.
What are the key properties of 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide?
4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide has a molecular weight of 383.43 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)-N-methylbenzenesulfonamide is sourced from PubChem (CID 118918718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).