N,N-Dimethyl-5-phenylpentan-1-amine

Base Information

• Chemical Name: N,N-Dimethyl-5-phenylpentan-1-amine
• CAS No.: 62101-01-3
• Molecular Formula: C13H21N
• Molecular Weight: 191.316
• ChEMBL ID: CHEMBL21023
• DSSTox Substance ID: DTXSID10492891
• Nikkaji Number: J587.682F
• Pharos Ligand ID: JQVHMXK4UVT6
• Wikidata: Q82339112
• Mol file: 62101-01-3.mol

Synonyms:CHEMBL21023;N,N-Dimethyl-5-phenylpentan-1-amine;62101-01-3;SCHEMBL8084103;DTXSID10492891;Dimethyl-(5-phenyl-pentyl)-amine;BDBM50041272

Chemical Property of N,N-Dimethyl-5-phenylpentan-1-amine

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 191.167399674
• Heavy Atom Count: 14
• Complexity: 125

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCCCC1=CC=CC=C1

Technology Process of N,N-Dimethyl-5-phenylpentan-1-amine

There total 8 articles about N,N-Dimethyl-5-phenylpentan-1-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: 79.0%

N,N-dimethyl-5-phenylpentanamide (40286-74-6) → N,N-dimethyl-5-phenylpentan-1-amine (62101-01-3)

Guidance literature:

With sodium hydride; zinc(II) chloride; In tetrahydrofuran; mineral oil; at 60 ℃; for 0.75h; Sealed tube;

DOI:10.1002/anie.201900233

Reference yield: 77.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 5-phenylpentylamine (17734-21-3) → N,N-dimethyl-5-phenylpentan-1-amine (62101-01-3)

Guidance literature:

With formic acid; at 0 - 20 ℃; for 16h; Reflux;

DOI:10.1021/acs.orglett.6b02003

Reference yield: 45.0%

N,N-dimethyl-5-phenylpentanamide (40286-74-6) → 5-phenylpentan-1-ol (10521-91-2) + N,N-dimethyl-5-phenylpentan-1-amine (62101-01-3)

Guidance literature:

With sodium hydride; sodium iodide; zinc(II) iodide; In tetrahydrofuran; mineral oil; at 40 ℃; for 9h; Sealed tube;

DOI:10.1002/anie.201900233

upstream raw materials:

trimethyl-(5-phenyl-pentyl)-ammonium; iodide

trans-N,N-dimethyl-5-phenyl-4-penten-1-amine

formaldehyd

5-phenylpentylamine

Downstream raw materials:

UN⁽¹⁰⁰⁾C₁₀₀₀₇A

dimethyl-[5-(4-nitro-phenyl)-pentyl]-amine