N-benzylthiophene-2-sulfonamide

C11H11NO2S2 — CID 765826

IUPACN-benzylthiophene-2-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)c1cccs1
InChIInChI=1S/C11H11NO2S2/c13-16(14,11-7-4-8-15-11)12-9-10-5-2-1-3-6-10/h1-8,12H,9H2
InChIKeyZBWRRXATZZOORF-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.23
Rot. Bonds4

About N-benzylthiophene-2-sulfonamide

N-benzylthiophene-2-sulfonamide (PubChem CID 765826) has the molecular formula C11H11NO2S2 and a molecular weight of 253.35 g/mol. Its IUPAC name is N-benzylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-benzylthiophene-2-sulfonamide
PubChem CID765826
Molecular FormulaC11H11NO2S2
Molecular Weight253.35 g/mol
Exact Mass253.02
IUPAC NameN-benzylthiophene-2-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)c1cccs1
InChIInChI=1S/C11H11NO2S2/c13-16(14,11-7-4-8-15-11)12-9-10-5-2-1-3-6-10/h1-8,12H,9H2
InChIKeyZBWRRXATZZOORF-UHFFFAOYSA-N
XLogP2.23
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzylthiophene-2-sulfonamide?
The IUPAC name of N-benzylthiophene-2-sulfonamide (CID 765826) is N-benzylthiophene-2-sulfonamide.
What is the SMILES notation for N-benzylthiophene-2-sulfonamide?
The canonical SMILES for N-benzylthiophene-2-sulfonamide is O=S(=O)(NCc1ccccc1)c1cccs1.
What is the InChIKey of N-benzylthiophene-2-sulfonamide?
The InChIKey is ZBWRRXATZZOORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2S2/c13-16(14,11-7-4-8-15-11)12-9-10-5-2-1-3-6-10/h1-8,12H,9H2.
What are the key properties of N-benzylthiophene-2-sulfonamide?
N-benzylthiophene-2-sulfonamide has a molecular weight of 253.35 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzylthiophene-2-sulfonamide is sourced from PubChem (CID 765826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).