4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide

C11H17N3O2S — CID 114803174

IUPAC4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCC(N)c2ccccc21
InChIInChI=1S/C11H17N3O2S/c1-2-13-17(15,16)14-8-7-10(12)9-5-3-4-6-11(9)14/h3-6,10,13H,2,7-8,12H2,1H3
InChIKeySPUPKNWPXBWWEY-UHFFFAOYSA-N
MW255.34 g/mol
LogP0.75
Rot. Bonds3

About 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide

4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide (PubChem CID 114803174) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide
PubChem CID114803174
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCC(N)c2ccccc21
InChIInChI=1S/C11H17N3O2S/c1-2-13-17(15,16)14-8-7-10(12)9-5-3-4-6-11(9)14/h3-6,10,13H,2,7-8,12H2,1H3
InChIKeySPUPKNWPXBWWEY-UHFFFAOYSA-N
XLogP0.75
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide?
The IUPAC name of 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide (CID 114803174) is 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide.
What is the SMILES notation for 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide?
The canonical SMILES for 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide is CCNS(=O)(=O)N1CCC(N)c2ccccc21.
What is the InChIKey of 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide?
The InChIKey is SPUPKNWPXBWWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-2-13-17(15,16)14-8-7-10(12)9-5-3-4-6-11(9)14/h3-6,10,13H,2,7-8,12H2,1H3.
What are the key properties of 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide?
4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide has a molecular weight of 255.34 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-3,4-dihydro-2H-quinoline-1-sulfonamide is sourced from PubChem (CID 114803174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).