N-(1-thiophen-2-ylpropyl)ethanesulfonamide

C9H15NO2S2 — CID 47372817

IUPACN-(1-thiophen-2-ylpropyl)ethanesulfonamide
SMILESCCC(NS(=O)(=O)CC)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-3-8(9-6-5-7-13-9)10-14(11,12)4-2/h5-8,10H,3-4H2,1-2H3
InChIKeyMKNMWJKTPWHBAK-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.14
Rot. Bonds5

About N-(1-thiophen-2-ylpropyl)ethanesulfonamide

N-(1-thiophen-2-ylpropyl)ethanesulfonamide (PubChem CID 47372817) has the molecular formula C9H15NO2S2 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-(1-thiophen-2-ylpropyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylpropyl)ethanesulfonamide
PubChem CID47372817
Molecular FormulaC9H15NO2S2
Molecular Weight233.36 g/mol
Exact Mass233.05
IUPAC NameN-(1-thiophen-2-ylpropyl)ethanesulfonamide
SMILESCCC(NS(=O)(=O)CC)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-3-8(9-6-5-7-13-9)10-14(11,12)4-2/h5-8,10H,3-4H2,1-2H3
InChIKeyMKNMWJKTPWHBAK-UHFFFAOYSA-N
XLogP2.14
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(sulfamoylamino)propyl]thiophene
CID 112686147
N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide
CID 56791791
4-(propylamino)-N-(1-thiophen-2-ylpropyl)butane-1-sulfonamide
CID 106053458
N-(1-thiophen-2-ylpropyl)pyrrolidine-1-sulfonamide
CID 131924146
3-bromo-N-(1-thiophen-2-ylpropyl)thiophene-2-sulfonamide
CID 61068284
2-[(2R)-oxolan-2-yl]-N-[(1R)-1-thiophen-2-ylpropyl]ethanesulfonamide
CID 97096482
3-(aminomethyl)-2-methyl-N-(1-thiophen-2-ylpropyl)benzenesulfonamide
CID 106053446
N-(1-thiophen-2-ylpropyl)morpholine-4-sulfonamide
CID 47306222
2-[1-[[methyl-[3-(methylamino)propyl]sulfamoyl]amino]propyl]thiophene
CID 106053430
1-(cyclopropylamino)-N-(1-thiophen-2-ylpropyl)propane-2-sulfonamide
CID 106053417
5-(methylaminomethyl)-N-(1-thiophen-2-ylpropyl)thiophene-2-sulfonamide
CID 106053416
5-(1-thiophen-2-ylpropylsulfamoyl)thiophene-3-carboxylic acid
CID 61068619

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylpropyl)ethanesulfonamide?
The IUPAC name of N-(1-thiophen-2-ylpropyl)ethanesulfonamide (CID 47372817) is N-(1-thiophen-2-ylpropyl)ethanesulfonamide.
What is the SMILES notation for N-(1-thiophen-2-ylpropyl)ethanesulfonamide?
The canonical SMILES for N-(1-thiophen-2-ylpropyl)ethanesulfonamide is CCC(NS(=O)(=O)CC)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylpropyl)ethanesulfonamide?
The InChIKey is MKNMWJKTPWHBAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2S2/c1-3-8(9-6-5-7-13-9)10-14(11,12)4-2/h5-8,10H,3-4H2,1-2H3.
What are the key properties of N-(1-thiophen-2-ylpropyl)ethanesulfonamide?
N-(1-thiophen-2-ylpropyl)ethanesulfonamide has a molecular weight of 233.36 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylpropyl)ethanesulfonamide is sourced from PubChem (CID 47372817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).