N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide

C13H15NO2S2 — CID 60705383

IUPACN-(2-thiophen-2-ylphenyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccccc1-c1cccs1
InChIInChI=1S/C13H15NO2S2/c1-2-10-18(15,16)14-12-7-4-3-6-11(12)13-8-5-9-17-13/h3-9,14H,2,10H2,1H3
InChIKeyLGLGVSINJWGDSP-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.57
Rot. Bonds5

About N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide

N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide (PubChem CID 60705383) has the molecular formula C13H15NO2S2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-thiophen-2-ylphenyl)propane-1-sulfonamide
PubChem CID60705383
Molecular FormulaC13H15NO2S2
Molecular Weight281.40 g/mol
Exact Mass281.05
IUPAC NameN-(2-thiophen-2-ylphenyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccccc1-c1cccs1
InChIInChI=1S/C13H15NO2S2/c1-2-10-18(15,16)14-12-7-4-3-6-11(12)13-8-5-9-17-13/h3-9,14H,2,10H2,1H3
InChIKeyLGLGVSINJWGDSP-UHFFFAOYSA-N
XLogP3.57
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-heptan-4-yl-2-thiophen-2-ylaniline
CID 43724523
N-(2-fluorophenyl)propane-1-sulfonamide
CID 60640812
N-methyl-4-[(2-thiophen-2-ylphenyl)sulfamoyl]benzamide
CID 17467119
N-(4-methylcyclohexyl)-2-thiophen-2-ylaniline
CID 43724474
1-(methoxymethyl)-3,5-dimethyl-N-(2-thiophen-2-ylphenyl)pyrazole-4-sulfonamide
CID 99784462
N-(2-pyridin-4-ylphenyl)ethanesulfonamide
CID 86799036
N-(2-ethoxyphenyl)propane-1-sulfonamide
CID 60641405
N-[2-(trifluoromethyl)phenyl]propane-1-sulfonamide
CID 60640821
3-(diethylsulfamoyl)-N-(2-thiophen-2-ylphenyl)benzamide
CID 55469920
2-(2-thiophen-2-ylanilino)propanoic acid
CID 66173526
N-[2-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)ethyl]propane-1-sulfonamide
CID 16905752
4-methyl-N-(2-thiophen-2-ylphenyl)cycloheptan-1-amine
CID 65080513

Frequently Asked Questions

What is the IUPAC name of N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide?
The IUPAC name of N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide (CID 60705383) is N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide.
What is the SMILES notation for N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide?
The canonical SMILES for N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide is CCCS(=O)(=O)Nc1ccccc1-c1cccs1.
What is the InChIKey of N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide?
The InChIKey is LGLGVSINJWGDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S2/c1-2-10-18(15,16)14-12-7-4-3-6-11(12)13-8-5-9-17-13/h3-9,14H,2,10H2,1H3.
What are the key properties of N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide?
N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide has a molecular weight of 281.40 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiophen-2-ylphenyl)propane-1-sulfonamide is sourced from PubChem (CID 60705383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).