Cas no 902837-07-4 (1-(6-n-Butoxy-2-pyridyl)piperazine)

1-(6-n-Butoxy-2-pyridyl)piperazine is a specialized organic compound featuring a pyridylpiperazine core with a butoxy substituent at the 6-position. This structure makes it a valuable intermediate in pharmaceutical and agrochemical research, particularly in the synthesis of bioactive molecules. The butoxy group enhances lipophilicity, potentially improving membrane permeability in drug design applications. Its piperazine moiety offers versatility as a building block for further functionalization, enabling the development of compounds with tailored pharmacological properties. The compound is typically characterized by high purity and stability, ensuring reliable performance in synthetic workflows. Its utility in medicinal chemistry stems from its balanced reactivity and compatibility with diverse reaction conditions.
1-(6-n-Butoxy-2-pyridyl)piperazine structure
902837-07-4 structure
Product Name:1-(6-n-Butoxy-2-pyridyl)piperazine
CAS No:902837-07-4
MF:C13H21N3O
MW:235.3253428936
CID:93195
PubChem ID:28054514
Update Time:2025-11-02

1-(6-n-Butoxy-2-pyridyl)piperazine Chemical and Physical Properties

Names and Identifiers

    • 1-(6-n-Butoxy-2-pyridyl)piperazine
    • 1-(6-BUTOXYPYRIDIN-2-YL)PIPERAZINE
    • DTXSID60650767
    • CS-0357900
    • 1-(6-Butoxy-2-pyridinyl)piperazine, AldrichCPR
    • 902837-07-4
    • AKOS015839658
    • SCHEMBL3109301
    • MDL： MFCD08061085
    • Inchi： 1S/C13H21N3O/c1-2-3-11-17-13-6-4-5-12(15-13)16-9-7-14-8-10-16/h4-6,14H,2-3,7-11H2,1H3
    • InChI Key： PPOHEYKESQFZEC-UHFFFAOYSA-N
    • SMILES： O(CCCC)C1=CC=CC(=N1)N1CCNCC1

Computed Properties

  • Exact Mass: 235.16800
  • Monoisotopic Mass: 235.168462302g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 207
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.2
  • Topological Polar Surface Area: 37.4?2

Experimental Properties

  • Color/Form: Viscous liquid
  • PSA: 37.39000
  • LogP: 2.06390
  • Solubility: Not determined

1-(6-n-Butoxy-2-pyridyl)piperazine Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1-(6-n-Butoxy-2-pyridyl)piperazine Pricemore >>

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1-(6-n-Butoxy-2-pyridyl)piperazine Related Literature

Additional information on 1-(6-n-Butoxy-2-pyridyl)piperazine

Comprehensive Overview of 1-(6-n-Butoxy-2-pyridyl)piperazine (CAS No. 902837-07-4)

1-(6-n-Butoxy-2-pyridyl)piperazine (CAS No. 902837-07-4) is a specialized organic compound that has garnered significant attention in pharmaceutical and chemical research due to its unique structural properties. This compound, featuring a piperazine ring linked to a 6-n-butoxy-2-pyridyl moiety, serves as a key intermediate in the synthesis of various bioactive molecules. Researchers and industry professionals are increasingly interested in its potential applications, particularly in drug discovery and material science.

The molecular structure of 1-(6-n-Butoxy-2-pyridyl)piperazine combines the flexibility of the piperazine ring with the aromatic characteristics of the pyridine derivative. This combination enhances its utility in designing compounds with specific binding affinities, making it valuable for pharmaceutical intermediates and ligand development. Recent trends in AI-driven drug discovery and computational chemistry have further highlighted the importance of such tailored molecules in accelerating research processes.

One of the most searched questions related to 1-(6-n-Butoxy-2-pyridyl)piperazine is its role in central nervous system (CNS) drug development. The piperazine scaffold is known for its prevalence in CNS-active compounds, and modifications like the 6-n-butoxy-2-pyridyl group can fine-tune pharmacological properties. Additionally, its potential in catalysis and coordination chemistry is a growing area of exploration, aligning with the increasing demand for sustainable and efficient chemical processes.

From a market perspective, the demand for high-purity 1-(6-n-Butoxy-2-pyridyl)piperazine is rising, driven by advancements in custom synthesis and contract research organizations (CROs). Companies specializing in fine chemicals and pharmaceutical intermediates are actively sourcing this compound to support innovative projects. Its stability under various conditions and compatibility with multiple reaction pathways make it a versatile choice for laboratory-scale and industrial-scale applications.

In summary, 1-(6-n-Butoxy-2-pyridyl)piperazine (CAS No. 902837-07-4) represents a critical building block in modern chemistry, with applications spanning drug discovery, material science, and catalysis. Its unique structure and adaptability position it as a compound of interest for researchers and industry leaders alike, particularly in the context of emerging technologies like AI-assisted molecular design and green chemistry.

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