2,2-dimethyl-N-(1-phenylethyl)propanamide

Base Information

• Chemical Name: 2,2-dimethyl-N-(1-phenylethyl)propanamide
• CAS No.: 64528-63-8
• Molecular Formula: C13H19NO
• Molecular Weight: 205.3
• DSSTox Substance ID: DTXSID20401252
• Nikkaji Number: J514.022F
• Mol file: 64528-63-8.mol

Synonyms:2,2-dimethyl-N-(1-phenylethyl)propanamide;64528-63-8;SCHEMBL4270022;DTXSID20401252;AKOS003868819;SB77668;2,3-methyl-N-(2'-phenylethyl) isobutyramide;Z54930711

Chemical Property of 2,2-dimethyl-N-(1-phenylethyl)propanamide

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 205.146664230
• Heavy Atom Count: 15
• Complexity: 211

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=CC=C1)NC(=O)C(C)(C)C

Technology Process of 2,2-dimethyl-N-(1-phenylethyl)propanamide

There total 14 articles about 2,2-dimethyl-N-(1-phenylethyl)propanamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

pivaloyl chloride (3282-30-2) + rac-methylbenzylamine (618-36-0) → N-(1-phenylethyl)pivalamide (64528-63-8)

Guidance literature:

With zinc; In toluene; for 0.166667h; Ambient temperature;

DOI:10.1016/S0040-4039(98)00666-2

Reference yield: 92.0%

rac-methylbenzylamine (618-36-0) + N-(4,4-dimethyl-4,5-dihydro-thiazol-2-yl)-2,2,N-trimethyl-propionamide (515863-57-7) → N-(1-phenylethyl)pivalamide (64528-63-8)

Guidance literature:

In tetrachloromethane; at 20 ℃; for 24h;

DOI:10.1016/S0040-4039(02)02414-0

Reference yield: 90.0%

→ N-(1-phenylethyl)pivalamide (64528-63-8)

Guidance literature:

upstream raw materials:

pivaloyl chloride

rac-methylbenzylamine

4-Phenylbutyric acid

Trimethylacetic acid

Downstream raw materials:

2,2-dimethylpropionamide

(R)-(+)-N-(1-phenylethyl)-2,2-dimethylpropanamide

(1S)-(+)-N-(2,2-dimethylpropionyl)-1-phenylethylamine

2,2-dimethyl-N-[1-phenylethyl]propanethioamide