5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide

C18H20N2O3S2 — CID 56574545

IUPAC5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCCOc2cccc3cccnc23)s1
InChIInChI=1S/C18H20N2O3S2/c1-2-15-9-10-17(24-15)25(21,22)20-12-5-13-23-16-8-3-6-14-7-4-11-19-18(14)16/h3-4,6-11,20H,2,5,12-13H2,1H3
InChIKeyACCSLVVJWWSHEW-UHFFFAOYSA-N
MW376.50 g/mol
LogP3.61
Rot. Bonds8

About 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide

5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide (PubChem CID 56574545) has the molecular formula C18H20N2O3S2 and a molecular weight of 376.50 g/mol. Its IUPAC name is 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide
PubChem CID56574545
Molecular FormulaC18H20N2O3S2
Molecular Weight376.50 g/mol
Exact Mass376.09
IUPAC Name5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCCCOc2cccc3cccnc23)s1
InChIInChI=1S/C18H20N2O3S2/c1-2-15-9-10-17(24-15)25(21,22)20-12-5-13-23-16-8-3-6-14-7-4-11-19-18(14)16/h3-4,6-11,20H,2,5,12-13H2,1H3
InChIKeyACCSLVVJWWSHEW-UHFFFAOYSA-N
XLogP3.61
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-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

3-methylsulfonyl-N-(3-quinolin-8-yloxypropyl)benzenesulfonamide
CID 56541916
3,4-dimethyl-N-(2-quinolin-8-yloxyethyl)benzenesulfonamide
CID 113102271
3-bromo-N-(3-quinolin-8-yloxypropyl)benzenesulfonamide
CID 56541607
ethyl 4-(3-quinolin-8-yloxypropylsulfamoyl)benzoate
CID 56541641
N-[2-(2,5-dimethylphenoxy)ethyl]-5-ethylthiophene-2-sulfonamide
CID 113100868
4-propan-2-yloxy-N-(2-quinolin-8-yloxyethyl)benzenesulfonamide
CID 113102304
4-(3-chloropropyl)-N-(3-quinolin-8-yloxypropyl)benzenesulfonamide
CID 56541471
5-chloro-1,3-dimethyl-N-(3-quinolin-8-yloxypropyl)pyrazole-4-sulfonamide
CID 167874233
4-chloro-N-(2-quinolin-8-yloxyethyl)benzenesulfonamide
CID 30206083
5-ethyl-N-hex-5-ynylthiophene-2-sulfonamide
CID 103756970
N-[2-(4-ethoxyphenoxy)ethyl]-5-ethylthiophene-2-sulfonamide
CID 30366253
N-(3-bromopropyl)-5-ethylthiophene-2-sulfonamide
CID 61454391

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide (CID 56574545) is 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCCCOc2cccc3cccnc23)s1.
What is the InChIKey of 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide?
The InChIKey is ACCSLVVJWWSHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S2/c1-2-15-9-10-17(24-15)25(21,22)20-12-5-13-23-16-8-3-6-14-7-4-11-19-18(14)16/h3-4,6-11,20H,2,5,12-13H2,1H3.
What are the key properties of 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide?
5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide has a molecular weight of 376.50 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-quinolin-8-yloxypropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 56574545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).