4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide

C17H18N2O4S — CID 18125908

IUPAC4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide
SMILESCOc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C17H18N2O4S/c1-23-14-6-9-16-13(11-14)3-2-10-19(16)24(21,22)15-7-4-12(5-8-15)17(18)20/h4-9,11H,2-3,10H2,1H3,(H2,18,20)
InChIKeyOBUCWMDNAOTQHI-UHFFFAOYSA-N
MW346.41 g/mol
LogP1.94
Rot. Bonds4

About 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide

4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide (PubChem CID 18125908) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide.

Molecular Properties

Compound Name4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide
PubChem CID18125908
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC Name4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide
SMILESCOc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(C(N)=O)cc1
InChIInChI=1S/C17H18N2O4S/c1-23-14-6-9-16-13(11-14)3-2-10-19(16)24(21,22)15-7-4-12(5-8-15)17(18)20/h4-9,11H,2-3,10H2,1H3,(H2,18,20)
InChIKeyOBUCWMDNAOTQHI-UHFFFAOYSA-N
XLogP1.94
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide 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

4-methoxy-N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]benzenesulfonamide
CID 27443628
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-3,4-dimethylbenzamide
CID 27510027
5-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-1-methyl-3H-indol-2-one
CID 24602697
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]cyclohexanecarboxamide
CID 27443573
1-(4-chlorophenyl)sulfonyl-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H-quinoline-6-carboxamide
CID 100770223
1-(4-bromophenyl)sulfonyl-3,4-dihydro-2H-quinoline-6-carboxylic acid
CID 52582833
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-3-methylbutanamide
CID 27368896
N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]-3-methylbenzamide
CID 27537420
2-(2-methoxyphenoxy)-N-[1-(4-methoxyphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]acetamide
CID 27443582
6-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]chromen-2-one
CID 30713933
3,4-dimethoxy-N-[1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-6-yl]benzamide
CID 16825758
2-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]propanoic acid
CID 61455016

Frequently Asked Questions

What is the IUPAC name of 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide?
The IUPAC name of 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide (CID 18125908) is 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide.
What is the SMILES notation for 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide?
The canonical SMILES for 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide is COc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide?
The InChIKey is OBUCWMDNAOTQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4S/c1-23-14-6-9-16-13(11-14)3-2-10-19(16)24(21,22)15-7-4-12(5-8-15)17(18)20/h4-9,11H,2-3,10H2,1H3,(H2,18,20).
What are the key properties of 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide?
4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide has a molecular weight of 346.41 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]benzamide is sourced from PubChem (CID 18125908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).