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Aliskiren

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Identification
Molecular formula
C30H53N3O6
CAS number
173334-57-1
IUPAC name
4-(aminomethyl)-N-[2-(octylamino)-2-oxo-1-[[4-(4-pyridylmethoxy)phenyl]methyl]ethyl]cyclohexanecarboxamide
State
State

Aliskiren is a solid at room temperature, often prepared as tablets for therapeutic use.

Melting point (Celsius)
141.00
Melting point (Kelvin)
414.15
Boiling point (Celsius)
607.20
Boiling point (Kelvin)
880.30
General information
Molecular weight
609.83g/mol
Molar mass
609.8250g/mol
Density
1.0908g/cm3
Appearence

Aliskiren is typically a white to practically white or off-white powder.

Comment on solubility

Solubility of 4-(aminomethyl)-N-[2-(octylamino)-2-oxo-1-[[4-(4-pyridylmethoxy)phenyl]methyl]ethyl]cyclohexanecarboxamide

This compound, with the chemical formula C30H53N3O6, presents an interesting profile when it comes to solubility. The solubility of such complex organic molecules can significantly vary depending on several factors:

  • Polarity: Due to the presence of multiple amine groups and a cyclic structure, the compound may exhibit a degree of polar character. Generally, compounds with polar functional groups tend to be more soluble in polar solvents like water.
  • Hydrophobic Regions: The octylamino group indicates a significant hydrophobic (water-repelling) portion of the molecule. This characteristic can limit solubility in polar solvents, suggesting that it may favor dissolution in non-polar solvents such as hexane or octanol.
  • Temperature Dependency: Temperature can greatly influence solubility. Increased temperatures often enhance the solubility of organic compounds, making it likely that the solubility of this compound could increase as the temperature rises.
  • Interactions: The presence of functional groups such as the pyridylmethoxy or carboxamide might lead to specific interactions with solvents (such as hydrogen bonding), which can either improve or hinder solubility.

In conclusion, while predicting the exact solubility requires empirical data, it's clear that the unique structure of this compound suggests it may exhibit varied solubility characteristics. As the old adage in chemistry states, "like dissolves like". Therefore, testing in both polar and non-polar environments will be essential to accurately gauge its solubility profile.

Interesting facts

Interesting Facts About 4-(aminomethyl)-N-[2-(octylamino)-2-oxo-1-[[4-(4-pyridylmethoxy)phenyl]methyl]ethyl]cyclohexanecarboxamide

This compound, often referred to in the scientific community for its complex structure and significant potential, is a member of the carboxamide class. Its unique combination of functional groups contributes to several interesting properties and applications:

  • Pharmaceutical Potential: Due to its intricate structure and functionalization, this compound may exhibit interesting biological activities, making it a candidate for drug development.
  • Amine Functionality: The presence of amine groups in its structure allows for the possibility of forming hydrogen bonds, which is crucial in biochemical interactions.
  • Substituents Influence: The presence of long alkyl chains, such as the octylamino group, can influence the lipid solubility and membrane permeability of molecules, enhancing their bioavailability.
  • Pyridyl Component: The inclusion of a pyridyl group can contribute to π-π stacking interactions, which are essential in drug binding to receptors and proteins.
  • Structural Diversity: The cyclohexane ring offers conformational flexibility, which is important in facilitating the necessary orientations for interactions in biological systems.

In their studies, many chemists emphasize the importance of diversity in compound design: “Innovative angles can lead to unexpected breakthroughs in medicinal chemistry!” This compound exemplifies the complexity and creativity inherent in the synthesis of new chemical entities.

The exploration of such compounds opens up new avenues in research, potentially leading to advancements in treatments for various diseases. As a researcher or student in the field, understanding the structure-activity relationship of this compound can provide valuable insights into the development of new therapeutics.

Synonyms
CHEMBL3084797
4-(aminomethyl)-N-[1-(octylamino)-1-oxo-3-[4-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]-1-cyclohexanecarboxamide
4-(aminomethyl)-N-[1-(octylamino)-1-oxo-3-[4-(pyridin-4-ylmethoxy)phenyl]propan-2-yl]cyclohexane-1-carboxamide
CHEBI:91491
BDBM50092331
HSCI1_000248
BRD-A04026261-001-01-0
Q27163328
4-Aminomethyl-cyclohexanecarboxylic acid {1-octylcarbamoyl-2-[4-(pyridin-4-ylmethoxy)-phenyl]-ethyl}-amide