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Identification
Molecular formula
C10H12ClNO2
CAS number
1134-47-0
IUPAC name
3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one
State
State

Solid at room temperature.

Melting point (Celsius)
206.00
Melting point (Kelvin)
479.15
Boiling point (Celsius)
233.00
Boiling point (Kelvin)
506.15
General information
Molecular weight
213.09g/mol
Molar mass
213.0910g/mol
Density
1.3660g/cm3
Appearence

White crystalline powder.

Comment on solubility

Solubility of 3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one

3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one is a complex organic compound with unique solubility characteristics. Understanding its solubility is crucial for applications in pharmaceuticals and material science.

Here are some key points regarding its solubility:

  • Polarity: The presence of multiple substituents affects the overall polarity of the molecule, which in turn influences its solubility in various solvents.
  • Solvent Compatibility: It is generally more soluble in organic solvents such as:
    • Dimethyl sulfoxide (DMSO)
    • Ethyl acetate
    • Acetonitrile
  • Water Solubility: Due to the hydrophobic character imparted by the trimethyl groups and the azepine ring, it is expected to have limited solubility in water.
  • Temperature Dependency: Like many organic compounds, its solubility may increase with temperature, which is important during pharmaceutical formulations.

In summary, the solubility of 3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one is primarily influenced by its structure, polarity, and the nature of the solvent used. Thus, careful consideration is essential when determining the optimal conditions for dissolution.

Interesting facts

Interesting Facts about 3,5,7-Trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one

The compound 3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one is an intriguing example of organic chemistry that showcases the complexity and versatility of nitrogen-containing heterocycles. Here are some significant facts about this unique compound:

  • Structural Features: This compound contains a seven-membered ring structure known as an azepine, which is chemically significant due to its potential biological activity. The presence of multiple methyl groups at the 3, 5, and 7 positions imparts distinct chemical properties and steric effects.
  • Biological Relevance: Nitrogen heterocycles like azepines are often found in many natural products and pharmaceuticals, contributing to a range of biological functions, including neuroactivity and potential therapeutic applications.
  • Functional Groups: The inclusion of a pyrrolidine moiety can enhance solubility and increase the molecular interaction with biological targets, making this compound a potential candidate for drug design and development.
  • Synthetic Routes: The synthesis of this type of compound is fascinating and can involve various organic reactions like alkylation and cyclization, illustrating the creativity required in synthetic organic chemistry.
  • Research Opportunities: The exploration of this compound can lead to new insights in medicinal chemistry, particularly its influence on receptor interactions and its metabolic pathways within biological systems.

In summary, 3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one exemplifies the intricate relationship between structure and function in chemical compounds. As pharmacological research continues to flourish, this compound may hold the key to developing novel therapeutic agents that could address various health challenges.

Synonyms
1676-50-2
NSC135363
3,5,7-Trimethyl-1-(2-(1-pyrrolidinyl)propyl)-1,3-dihydro-2H-azepin-2-one
3,5,7-trimethyl-1-(2-pyrrolidin-1-ylpropyl)-3H-azepin-2-one
3,5,7-trimethyl-1-[2-(1-pyrrolidinyl)propyl]-1,3-dihydro-2H-azepin-2-one
NSC 135363
DTXSID40937366
AKOS024321400
NSC-135363
3,5,7-Trimethyl-1-[2-(pyrrolidin-1-yl)propyl]-1,3-dihydro-2H-azepin-2-one