1-(aminomethyl)-N,N-dimethylcyclopentan-1-amine

Base Information

• Chemical Name: 1-(aminomethyl)-N,N-dimethylcyclopentan-1-amine
• CAS No.: 164642-21-1
• Molecular Formula: C8H18N2
• Molecular Weight: 142.24200
• Hs Code.: 2921300090
• DSSTox Substance ID: DTXSID10445605
• Wikidata: Q82264080
• Mol file: 164642-21-1.mol

Synonyms:164642-21-1;N-[1-(aminomethyl)cyclopentyl]-N,N-dimethylamine;1-(aminomethyl)-N,N-dimethylcyclopentan-1-amine;1-(aminomethyl)-N,N-dimethylcyclopentanamine;(1-Aminomethyl-cyclopentyl)-dimethyl-amine;SCHEMBL2836174;SCHEMBL5024507;DTXSID10445605;OHQDEEKAUZTSQC-UHFFFAOYSA-N;MFCD09864515;STK502194;AKOS000168869;LS-01047;BB 0218753;CS-0307786;FT-0678888;EN300-07192;A882434;1-(Aminomethyl)-N,N-dimethylcyclopentanamine, AldrichCPR

Chemical Property of 1-(aminomethyl)-N,N-dimethylcyclopentan-1-amine

Chemical Property:

• Vapor Pressure: 1.771mmHg at 25°C
• Boiling Point: 166.593oC at 760 mmHg
• PKA: 10.27±0.29(Predicted)
• Flash Point: 55.943oC
• PSA: 29.26000
• Density: 0.929g/cm3
• LogP: 1.51980
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 142.146998583
• Heavy Atom Count: 10
• Complexity: 104

Purity/Quality:

98%min ^*data from raw suppliers

N-[1-(Aminomethyl)cyclopentyl]-N,N-dimethylamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22

MSDS Files:

Useful:

• Canonical SMILES: CN(C)C1(CCCC1)CN

Technology Process of 1-(aminomethyl)-N,N-dimethylcyclopentan-1-amine

There total 3 articles about 1-(aminomethyl)-N,N-dimethylcyclopentan-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: 56.0%

1-(dimethylamino)cyclopentanecarbonitrile (22912-31-8) → 1-(aminomethyl)-N,N-dimethylcyclopentane-1-amine (164642-21-1)

Guidance literature:

With lithium aluminium tetrahydride; sulfuric acid; In tetrahydrofuran; at 40 - 50 ℃; for 1h;

DOI:10.1016/0223-5234(96)89139-2

Reference yield:

cyclopentanone (120-92-3) → 1-(aminomethyl)-N,N-dimethylcyclopentane-1-amine (164642-21-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 87 percent / H₂O / Ambient temperature

2: 56 percent / LiAlH₄, H₂SO₄ / tetrahydrofuran / 1 h / 40 - 50 °C

With lithium aluminium tetrahydride; sulfuric acid; In tetrahydrofuran; water;

DOI:10.1016/0223-5234(96)89139-2

Reference yield:

cyclopentanone (120-92-3) → 1-(aminomethyl)-N,N-dimethylcyclopentane-1-amine (164642-21-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 52 percent / H₂O / 20 °C

2: 45 percent / LiAlH₄; H₂SO₄ / tetrahydrofuran / 3 h / 40 - 50 °C

With lithium aluminium tetrahydride; sulfuric acid; In tetrahydrofuran; water;

DOI:10.1002/jlcr.1145

upstream raw materials:

1-(dimethylamino)cyclopentanecarbonitrile

cyclopentanone

Refernces

• 1、 Yang,Bremont,Shen,Kefi,Langlois. "Serotoninergic properties of new conformationally restricted benzamides". . p. 231 - 239. Retrieved 2007/10/03.