2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide

C15H16N2O3S — CID 171054438

IUPAC2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide
SMILESC=CCN(CC=C)S(=O)(=O)c1cccc2ccc(=O)[nH]c12
InChIInChI=1S/C15H16N2O3S/c1-3-10-17(11-4-2)21(19,20)13-7-5-6-12-8-9-14(18)16-15(12)13/h3-9H,1-2,10-11H2,(H,16,18)
InChIKeySCHQJZHWOMDONP-UHFFFAOYSA-N
MW304.37 g/mol
LogP1.89
Rot. Bonds6

About 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide

2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide (PubChem CID 171054438) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide.

Molecular Properties

Compound Name2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide
PubChem CID171054438
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide
SMILESC=CCN(CC=C)S(=O)(=O)c1cccc2ccc(=O)[nH]c12
InChIInChI=1S/C15H16N2O3S/c1-3-10-17(11-4-2)21(19,20)13-7-5-6-12-8-9-14(18)16-15(12)13/h3-9H,1-2,10-11H2,(H,16,18)
InChIKeySCHQJZHWOMDONP-UHFFFAOYSA-N
XLogP1.89
TPSA70.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide 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

N,N-bis(prop-2-enyl)quinoline-8-sulfonamide
CID 3546701
8-ethenyl-1H-quinolin-2-one
CID 19892893
N-prop-2-enyl-N-propylnaphthalene-1-sulfonamide
CID 114795839
2,4-dioxo-N,N-bis(prop-2-enyl)-1H-pyrimidine-5-sulfonamide
CID 21008159
ethane;N-(piperidin-4-ylmethyl)-N-prop-2-enylnaphthalene-1-sulfonamide
CID 142910503
1H-benzo[h]quinolin-2-one
CID 12539195
copper;bis(8-hydroxy-1H-quinolin-2-one)
CID 66679069
N-(2-methoxyethyl)-2-methyl-N-prop-2-enylbenzenesulfonamide
CID 103340514
N-ethyl-2-fluoro-N-prop-2-enylbenzenesulfonamide
CID 115279924
(2-oxo-1H-quinolin-8-yl) hydrogen sulfate
CID 156960910
2,5-dibromo-N,N-bis(prop-2-enyl)benzenesulfonamide
CID 51888305
8-propyl-1H-quinolin-2-one
CID 10877864

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide?
The IUPAC name of 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide (CID 171054438) is 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide.
What is the SMILES notation for 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide?
The canonical SMILES for 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide is C=CCN(CC=C)S(=O)(=O)c1cccc2ccc(=O)[nH]c12.
What is the InChIKey of 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide?
The InChIKey is SCHQJZHWOMDONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-3-10-17(11-4-2)21(19,20)13-7-5-6-12-8-9-14(18)16-15(12)13/h3-9H,1-2,10-11H2,(H,16,18).
What are the key properties of 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide?
2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide has a molecular weight of 304.37 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N,N-bis(prop-2-enyl)-1H-quinoline-8-sulfonamide is sourced from PubChem (CID 171054438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).