4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Base Information

Chemical Name:4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester
CAS No.:177971-60-7
Molecular Formula:C₁₇H₃₁N₃O₃
Molecular Weight:325.451
Hs Code.:
DSSTox Substance ID:DTXSID10453200
Nikkaji Number:J729.157D
Wikidata:Q82274278
Mol file:177971-60-7.mol

Synonyms:177971-60-7;4-CYCLOHEXYLCARBAMOYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;tert-butyl 4-[2-(cyclohexylamino)-2-oxoethyl]piperazine-1-carboxylate;tert-butyl 4-(2-(cyclohexylamino)-2-oxoethyl)piperazine-1-carboxylate;DTXSID10453200;DJZDLYMUXBNSOW-UHFFFAOYSA-N;AKOS015911487;N-Cyclohexyl-4-(tert-butoxycarbonyl)piperazine-1-acetamide;TERT-BUTYL 4-[(CYCLOHEXYLCARBAMOYL)METHYL]PIPERAZINE-1-CARBOXYLATE;1-Piperazinecarboxylicacid,4-[2-(cyclohexylamino)-2-oxoethyl]-,1,1-dimethylethyl ester

Suppliers and Price of 4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
4-CYCLOHEXYLCARBAMOYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 95.00%
5MG
$ 495.50

Total 4 raw suppliers

Chemical Property of 4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Chemical Property:

PSA：61.88000
LogP:2.25470
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:325.23654186
Heavy Atom Count:23
Complexity:406

Purity/Quality:

99% ^*data from raw suppliers

4-CYCLOHEXYLCARBAMOYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2CCCCC2

Technology Process of 4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

There total 3 articles about 4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester 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:

: 23605-23-4
2-Chloro-N-cyclohexylacetamide

: 57260-71-6
1-t-Butoxycarbonylpiperazine

: 177971-60-7
4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Guidance literature:: With potassium carbonate; potassium iodide; In acetonitrile; at 75 ℃; for 8h;
DOI:10.1021/acs.jcim.9b00926

Reference yield:

: 108-91-8,157973-60-9
cyclohexylamine

: 177971-60-7
4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 5 h / 0 - 20 °C / Inert atmosphere

2: potassium carbonate; potassium iodide / acetonitrile / 8 h / 75 °C

With potassium carbonate; triethylamine; potassium iodide; In dichloromethane; acetonitrile;
DOI:10.1021/acs.jcim.9b00926

Reference yield:

: 108-91-8,157973-60-9
cyclohexylamine

: 79-08-3
bromoacetic acid

: 57260-71-6
1-t-Butoxycarbonylpiperazine

: 177971-60-7
4-Cyclohexylcarbamoylmethyl-piperazine-1-carboxylic acid tert-butyl ester

Guidance literature:: With dmap; aluminium trichloride; Wang resin; diisopropyl-carbodiimide; Yield given. Multistep reaction; 1.) DMF, 18 h, 2.) DMF, 18 h, 3.) CH₂Cl₂, RT, 18 h;
DOI:10.1016/0040-4039(96)00498-4