N-(1-phenylethyl)thiophene-2-sulfonamide

C12H13NO2S2 — CID 2880499

IUPACN-(1-phenylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C12H13NO2S2/c1-10(11-6-3-2-4-7-11)13-17(14,15)12-8-5-9-16-12/h2-10,13H,1H3
InChIKeyCYMOZMDLRXEQTP-UHFFFAOYSA-N
MW267.38 g/mol
LogP2.79
Rot. Bonds4

About N-(1-phenylethyl)thiophene-2-sulfonamide

N-(1-phenylethyl)thiophene-2-sulfonamide (PubChem CID 2880499) has the molecular formula C12H13NO2S2 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-(1-phenylethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-phenylethyl)thiophene-2-sulfonamide
PubChem CID2880499
Molecular FormulaC12H13NO2S2
Molecular Weight267.38 g/mol
Exact Mass267.04
IUPAC NameN-(1-phenylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C12H13NO2S2/c1-10(11-6-3-2-4-7-11)13-17(14,15)12-8-5-9-16-12/h2-10,13H,1H3
InChIKeyCYMOZMDLRXEQTP-UHFFFAOYSA-N
XLogP2.79
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethyl)thiophene-2-sulfonamide?
The IUPAC name of N-(1-phenylethyl)thiophene-2-sulfonamide (CID 2880499) is N-(1-phenylethyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(1-phenylethyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(1-phenylethyl)thiophene-2-sulfonamide is CC(NS(=O)(=O)c1cccs1)c1ccccc1.
What is the InChIKey of N-(1-phenylethyl)thiophene-2-sulfonamide?
The InChIKey is CYMOZMDLRXEQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2S2/c1-10(11-6-3-2-4-7-11)13-17(14,15)12-8-5-9-16-12/h2-10,13H,1H3.
What are the key properties of N-(1-phenylethyl)thiophene-2-sulfonamide?
N-(1-phenylethyl)thiophene-2-sulfonamide has a molecular weight of 267.38 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 2880499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).