N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide

C13H15NO2S2 — CID 5105833

IUPACN-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide
SMILESCC(Cc1cccs1)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C13H15NO2S2/c1-11(10-12-6-5-9-17-12)14-18(15,16)13-7-3-2-4-8-13/h2-9,11,14H,10H2,1H3
InChIKeyKAXHJMIDGJCEPI-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.66
Rot. Bonds5

About N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide

N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide (PubChem CID 5105833) has the molecular formula C13H15NO2S2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide
PubChem CID5105833
Molecular FormulaC13H15NO2S2
Molecular Weight281.40 g/mol
Exact Mass281.05
IUPAC NameN-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide
SMILESCC(Cc1cccs1)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C13H15NO2S2/c1-11(10-12-6-5-9-17-12)14-18(15,16)13-7-3-2-4-8-13/h2-9,11,14H,10H2,1H3
InChIKeyKAXHJMIDGJCEPI-UHFFFAOYSA-N
XLogP2.66
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 ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide?
The IUPAC name of N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide (CID 5105833) is N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide.
What is the SMILES notation for N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide?
The canonical SMILES for N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide is CC(Cc1cccs1)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide?
The InChIKey is KAXHJMIDGJCEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S2/c1-11(10-12-6-5-9-17-12)14-18(15,16)13-7-3-2-4-8-13/h2-9,11,14H,10H2,1H3.
What are the key properties of N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide?
N-(1-thiophen-2-ylpropan-2-yl)benzenesulfonamide has a molecular weight of 281.40 g/mol, XLogP of 2.66, 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-ylpropan-2-yl)benzenesulfonamide is sourced from PubChem (CID 5105833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).