2,2-Dimethylcyclopentan-1-amine

Base Information

• Chemical Name: 2,2-Dimethylcyclopentan-1-amine
• CAS No.: 345658-02-8
• Molecular Formula: C7H15N
• Molecular Weight: 113.203
• European Community (EC) Number: 831-570-6
• DSSTox Substance ID: DTXSID30569913
• Mol file: 345658-02-8.mol

Synonyms:2,2-dimethylcyclopentan-1-amine;345658-02-8;2,2-dimethyl-cyclopentylamine;2,2-DIMETHYL CYCLOPENTANAMINE;2,2-Dimethylcyclopentanamine;Cyclopentanamine, 2,2-dimethyl-;2,2-dimethylcyclopentylamine;SCHEMBL2377412;DTXSID30569913;NODFGJYBXPEUCQ-UHFFFAOYSA-N;MFCD13192715;AKOS006339604;SB36741;PS-20011;CS-0183552;EN300-101315;P20914

Chemical Property of 2,2-Dimethylcyclopentan-1-amine

Chemical Property:

• Boiling Point: 133.7±8.0 °C(Predicted)
• PKA: 10.85±0.40(Predicted)
• PSA: 26.02000
• Density: 0.840±0.06 g/cm3(Predicted)
• LogP: 2.22410
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 113.120449483
• Heavy Atom Count: 8
• Complexity: 86.4

Purity/Quality:

97% ^*data from raw suppliers

2,2-DimethylCyclopentanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCCC1N)C
• Uses: 2,2-DiMethyl CyclopentanaMine can be used for synthesis of 4-substituted benzamides as potent, selective, and orally bioavailable IKs blockers. 2,2-Dimethyl Cyclopentanamine is used for synthesis of 4-substituted benzamides as potent, selective, and orally bioavailable IKs blockers.

Technology Process of 2,2-Dimethylcyclopentan-1-amine

There total 3 articles about 2,2-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:

2,2-dimethylcyclopentanone (4541-32-6) → rac-2,2-dimethylcyclopentanamine (345658-02-8)

Guidance literature:

2,2-dimethylcyclopentanone; With ammonium formate; at 145 ℃;

With hydrogenchloride; In methanol; Further stages.;

DOI:10.1021/jm015505u

Reference yield:

N-benzyl-2,2-dimethylcyclopentanamine → rac-2,2-dimethylcyclopentanamine (345658-02-8)

Guidance literature:

With palladium on activated charcoal; hydrogen; In tetrahydrofuran; at 20 ℃;

DOI:10.1021/acs.jmedchem.7b01854

Reference yield:

→ rac-2,2-dimethylcyclopentanamine (345658-02-8)

Guidance literature:

upstream raw materials:

2,2-dimethylcyclopentanone

Refernces

• 1、 -. "THIADIAZOLEDIOXIDES AND THIADIAZOLEOXIDES AS CXC- AND CC-CHEMOKINE RECEPTOR LIGANDS". Page 284-285. . Retrieved 2008/06/13.
• 2、 -. "3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands". Page 156. . Retrieved 2008/06/13.