structure of n-(4-Cyanophenyl)-2-methylpropanamide

n-(4-Cyanophenyl)-2-methylpropanamide

CAS No.: 113715-23-4
M. Wt: 188.22600
M. Fa: C11H12N2O
InChI Key: WQZFOMXBTXLFNS-UHFFFAOYSA-N

Names and Identifiers of n-(4-Cyanophenyl)-2-methylpropanamide

CAS Number

113715-23-4

MDL Number

MFCD09040418

IUPAC Name

N-(4-cyanophenyl)-2-methylpropanamide

InChI

InChI=1S/C11H12N2O/c1-8(2)11(14)13-10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3,(H,13,14)

InChIKey

WQZFOMXBTXLFNS-UHFFFAOYSA-N

Canonical SMILES

CC(C)C(=O)NC1=CC=C(C#N)C=C1

UNSPSC Code

12352100

Physical and chemical properties of n-(4-Cyanophenyl)-2-methylpropanamide

Exact Mass

188.09500

H Bond Acceptors

2

H Bond Donors

1

LogP

2.22578

Molecular Formula

C11H12N2O

Molecular Weight

188.22600

PSA

52.89000

Safety Information of n-(4-Cyanophenyl)-2-methylpropanamide

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of n-(4-Cyanophenyl)-2-methylpropanamide

N-(4-cyanophenyl)-2-methylpropanamide finds applications in various fields:

  • Pharmaceuticals: It is investigated for its potential use in developing anti-inflammatory and analgesic drugs.
  • Chemical Research: The compound serves as a building block for synthesizing more complex organic molecules.
  • Material Science: Its unique properties may be explored in the development of new materials with specific functionalities.

Interaction Studies of n-(4-Cyanophenyl)-2-methylpropanamide

Interaction studies involving N-(4-cyanophenyl)-2-methylpropanamide focus on its binding affinity to various biological targets. Preliminary studies suggest that it may interact with certain receptors involved in pain and inflammation pathways, although detailed mechanisms are still under investigation.

Biological Activity of n-(4-Cyanophenyl)-2-methylpropanamide

Research indicates that N-(4-cyanophenyl)-2-methylpropanamide exhibits significant biological activity, particularly in pharmacological contexts. It has been studied for its potential anti-inflammatory and analgesic properties. The presence of the cyanophenyl group may enhance its interaction with biological targets, making it a candidate for further investigation in drug development.

Retrosynthesis analysis of n-(4-Cyanophenyl)-2-methylpropanamide

  • Route#1

    Cas:116275-13-9
    Cas:113715-23-4

  • Route#2

    Cas:873-74-5
    Cas:113715-23-4

  • Route#3

    Cas:3282-30-2
    Cas:873-74-5
    Cas:113715-23-4