Cas no 72914-15-9 (2-Pyridinamine, 4-(1-butylpentyl)-)

2-Pyridinamine, 4-(1-butylpentyl)-, is a substituted pyridine derivative characterized by its unique branched alkyl chain at the 4-position. This structural feature enhances its lipophilicity, making it suitable for applications requiring solubility in organic matrices. The compound's amine functionality provides a reactive site for further chemical modifications, enabling its use as an intermediate in pharmaceutical or agrochemical synthesis. Its well-defined molecular structure ensures consistent performance in research and industrial processes. The alkyl chain length may also influence its physicochemical properties, such as melting point and stability, offering flexibility for tailored applications. Proper handling and storage are recommended to maintain its integrity.
2-Pyridinamine, 4-(1-butylpentyl)- structure
72914-15-9 structure
Product Name:2-Pyridinamine, 4-(1-butylpentyl)-
CAS No:72914-15-9
MF:C14H24N2
MW:220.353763580322
CID:543269
PubChem ID:7330482
Update Time:2025-05-19

2-Pyridinamine, 4-(1-butylpentyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridinamine, 4-(1-butylpentyl)-
    • 4-(1-BUTYL-PENTYL)-PYRIDIN-2-YLAMINE
    • 4-nonan-5-ylpyridin-2-amine
    • 2-amino-4-(5 -nonyl)pyridine
    • 72914-15-9
    • CZBMURBNJQQQDC-UHFFFAOYSA-N
    • 4-(nonan-5-yl)pyridin-2-amine
    • DTXSID50428538
    • 4-(1-butylpentyl)pyridin-2-ylamine
    • 2-amino-4-(5-nonyl)pyridine
    • 2-amino-4(5-nonyl)-pyridine
    • SCHEMBL8527154
    • MDL: MFCD06637832
    • Inchi: 1S/C14H24N2/c1-3-5-7-12(8-6-4-2)13-9-10-16-14(15)11-13/h9-12H,3-8H2,1-2H3,(H2,15,16)
    • InChI Key: CZBMURBNJQQQDC-UHFFFAOYSA-N
    • SMILES: N1C=CC(=CC=1N)C(CCCC)CCCC

Computed Properties

  • Exact Mass: 220.19412
  • Monoisotopic Mass: 220.193948774g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 7
  • Complexity: 162
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.6
  • Topological Polar Surface Area: 38.9?2

Experimental Properties

  • PSA: 38.91

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Additional information on 2-Pyridinamine, 4-(1-butylpentyl)-

2-Pyridinamine, 4-(1-butylpentyl): A Comprehensive Overview

2-Pyridinamine, 4-(1-butylpentyl), also known by its CAS number 72914-15-9, is a compound of significant interest in the fields of organic chemistry and materials science. This compound belongs to the class of pyridinamines, which are derivatives of pyridine with an amine group attached. The specific structure of 2-Pyridinamine, 4-(1-butylpentyl) includes a pyridine ring with an amine group at the 2-position and a substituted alkyl chain at the 4-position. The substituent at the 4-position is a 1-butylpentyl group, which adds complexity to the molecule and potentially influences its chemical reactivity and physical properties.

The synthesis of 2-Pyridinamine, 4-(1-butylpentyl) typically involves multi-step organic reactions. One common approach is the nucleophilic substitution or coupling reactions, where the pyridine ring is functionalized with the desired substituents. Recent advancements in catalytic methods and transition metal-mediated reactions have enabled more efficient and selective syntheses of such compounds. For instance, researchers have employed palladium-catalyzed cross-coupling reactions to introduce the 1-butylpentyl group onto the pyridine ring with high precision.

The chemical structure of 2-Pyridinamine, 4-(1-butylpentyl) plays a crucial role in determining its properties. The pyridine ring is aromatic and contributes to the compound's stability. The amine group at the 2-position can participate in hydrogen bonding, making it potentially useful in various applications such as drug delivery or as a ligand in coordination chemistry. The presence of the bulky 1-butylpentyl group at the 4-position introduces steric hindrance, which can influence both the compound's solubility and its interactions with other molecules.

In terms of physical properties, 2-Pyridinamine, 4-(1-butylpentyl) is expected to have moderate solubility in organic solvents due to its alkyl chain. Its melting point and boiling point would depend on the extent of intermolecular forces, including hydrogen bonding from the amine group and van der Waals forces from the alkyl chain. Recent studies have focused on understanding how these properties can be tuned for specific applications.

The application potential of 2-Pyridinamine, 4-(1-butylpentyl) spans across various domains. In pharmaceuticals, such compounds are often explored as potential drug candidates due to their ability to interact with biological molecules through hydrogen bonding and other non-covalent interactions. For example, derivatives of pyridinamines have been investigated for their anti-inflammatory and anticancer properties. Additionally, in materials science, these compounds can serve as building blocks for advanced materials such as coordination polymers or metal-organic frameworks (MOFs), where their functional groups can act as ligands for metal ions.

Recent research has also delved into the catalytic applications of pyridinamines like 2-Pyridinamine, 4-(1-butylpentyl). These compounds have shown promise as organocatalysts in asymmetric synthesis reactions due to their ability to activate substrates through non-covalent interactions. For instance, studies have demonstrated their effectiveness in catalyzing aldol reactions and Michael additions under mild conditions.

In terms of environmental considerations, understanding the biodegradation and toxicity profiles of 2-Pyridinamine, 4-(1-butylpentyl) is crucial for its safe handling and application. Recent eco-toxicological studies have focused on assessing its potential impact on aquatic life and soil microorganisms. These studies are essential for ensuring that any industrial or pharmaceutical application does not pose significant risks to ecosystems.

In conclusion, 2-Pyridinamine, 4-(1-butylpentyl), with its unique chemical structure and versatile functional groups, represents a valuable compound for both academic research and industrial applications. Its synthesis methods continue to evolve with advancements in catalysis and organic synthesis techniques. As researchers uncover new insights into its properties and applications, this compound is poised to play an increasingly important role in diverse fields ranging from drug discovery to materials science.

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