Diethyl(piperidin-4-ylmethyl)amine

Base Information

• Chemical Name: Diethyl(piperidin-4-ylmethyl)amine
• CAS No.: 116905-90-9
• Molecular Formula: C10H22 N2
• Molecular Weight: 170.298
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID10395292
• Wikidata: Q82195284
• Mol file: 116905-90-9.mol

Synonyms:diethyl(piperidin-4-ylmethyl)amine;116905-90-9;N-ethyl-N-(piperidin-4-ylmethyl)ethanamine;N,N-DIETHYL-N-(PIPERIDIN-4-YLMETHYL)AMINE;SCHEMBL247608;4-(diethylaminomethyl)piperidine;DTXSID10395292;NBCRICNNRIGTEM-UHFFFAOYSA-N;diethyl[(piperidin-4-yl)methyl]amine;AKOS000124179;SB42733;EN300-42644;A1-08278;J-003480;Z317037046

Chemical Property of Diethyl(piperidin-4-ylmethyl)amine

Chemical Property:

• Boiling Point: 218.7±8.0 °C(Predicted)
• PKA: 10.54±0.10(Predicted)
• PSA: 15.27000
• Density: 0.865±0.06 g/cm3(Predicted)
• LogP: 1.65660
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 170.178298710
• Heavy Atom Count: 12
• Complexity: 104

Purity/Quality:

Diethyl(piperidin-4-ylmethyl)amine 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC1CCNCC1

Technology Process of Diethyl(piperidin-4-ylmethyl)amine

There total 6 articles about Diethyl(piperidin-4-ylmethyl)amine 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: 76.6%

N,N-diethyl-4-piperidinecarboxamide hydrochloride (95389-83-6) → 4-(N,N-diethylaminomethyl)piperidine (116905-90-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; Heating;

DOI:10.1248/cpb.42.74

Reference yield:

N-tert-butyloxycarbonyl-(4-diethylaminomethyl)piperidine → 4-(N,N-diethylaminomethyl)piperidine (116905-90-9)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 4h;

Reference yield:

N,N-diethylpiperidine-4-carboxamide (1903-67-9) → 4-(N,N-diethylaminomethyl)piperidine (116905-90-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃;

DOI:10.1016/j.ejmech.2018.03.060

upstream raw materials:

N,N-diethyl-4-piperidinecarboxamide hydrochloride

tert-butyl 4-(aminomethyl)piperidine-1-carboxylate

N,N-diethylpiperidine-4-carboxamide

N-[(tert-butoxy)carbonyl]piperidine-4-carboxylic acid

Downstream raw materials:

2-Chloro-1-(4-diethylaminomethyl-piperidin-1-yl)-2,2-diphenyl-ethanone

Refernces

• 1、 -. "QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS". Page/Page column 119; 120. . Retrieved 2014/10/03.