N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide

C24H22N2O3S — CID 138698781

IUPACN-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide
SMILESO=C1CCc2cc(C3(NS(=O)(=O)c4ccccc4)CC3)ccc2N1c1ccccc1
InChIInChI=1S/C24H22N2O3S/c27-23-14-11-18-17-19(12-13-22(18)26(23)20-7-3-1-4-8-20)24(15-16-24)25-30(28,29)21-9-5-2-6-10-21/h1-10,12-13,17,25H,11,14-16H2
InChIKeyMTDOEGVBBSDEMR-UHFFFAOYSA-N
MW418.52 g/mol
LogP4.27
Rot. Bonds5

About N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide

N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide (PubChem CID 138698781) has the molecular formula C24H22N2O3S and a molecular weight of 418.52 g/mol. Its IUPAC name is N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide
PubChem CID138698781
Molecular FormulaC24H22N2O3S
Molecular Weight418.52 g/mol
Exact Mass418.14
IUPAC NameN-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide
SMILESO=C1CCc2cc(C3(NS(=O)(=O)c4ccccc4)CC3)ccc2N1c1ccccc1
InChIInChI=1S/C24H22N2O3S/c27-23-14-11-18-17-19(12-13-22(18)26(23)20-7-3-1-4-8-20)24(15-16-24)25-30(28,29)21-9-5-2-6-10-21/h1-10,12-13,17,25H,11,14-16H2
InChIKeyMTDOEGVBBSDEMR-UHFFFAOYSA-N
XLogP4.27
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.52
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide with MolForge

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Related Compounds

N-(3,4-dimethylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 4547230
N-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 3656150
N-(3-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 7066682
N-(3-fluoro-4-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 3656145
7-{[(4-Fluorophenyl)sulfonyl]amino}-1,3,4-trihydroquinolin-2-one
CID 1505863
N-(3-ethylphenyl)-2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 6621438
2-(2-Oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-2-phenyl-N-[4-(propan-2-YL)phenyl]acetamide
CID 16008639
N-(4-butylphenyl)-11-oxo-1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-sulfonamide
CID 7161317
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 24981733
2-(2-Oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-3-phenyl-N-[4-(propan-2-YL)phenyl]propanamide
CID 16008975
2-oxo-N-phenyl-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 8466498
N-(2-methylphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 3648364

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide?
The IUPAC name of N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide (CID 138698781) is N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide.
What is the SMILES notation for N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide?
The canonical SMILES for N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide is O=C1CCc2cc(C3(NS(=O)(=O)c4ccccc4)CC3)ccc2N1c1ccccc1.
What is the InChIKey of N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide?
The InChIKey is MTDOEGVBBSDEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3S/c27-23-14-11-18-17-19(12-13-22(18)26(23)20-7-3-1-4-8-20)24(15-16-24)25-30(28,29)21-9-5-2-6-10-21/h1-10,12-13,17,25H,11,14-16H2.
What are the key properties of N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide?
N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide has a molecular weight of 418.52 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-oxo-1-phenyl-3,4-dihydroquinolin-6-yl)cyclopropyl]benzenesulfonamide is sourced from PubChem (CID 138698781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).