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CS-W001157 4
Total: USD 88.00

3-Methoxypiperidine

  • CAS No. 4045-29-8

  • Cat. No. CS-0051284
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Methoxypiperidine|CS-0051284

Structure of 4045-29-8

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General Information

  • CAS No. 4045-29-8
  • Cat. No. CS-0051284
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₃NO
  • Molecular Weight 115.17
  • Synonym(s) Piperidine, 3-methoxy-
  • SMILES COC1CCCNC1

Description

3-Methoxypiperidine is a bench-stable, moisture-tolerant heterocycle featuring a methoxy group at the 3-position of the piperidine ring. This substitution enhances solubility and modulates basicity, enabling efficient incorporation into bioactive molecules. The compound serves as a key building block in medicinal chemistry, where its polar yet lipophilic profile supports improved pharmacokinetic properties in drug candidates.

Application

3-Methoxypiperidine serves as a versatile building block in medicinal chemistry, offering a balanced combination of basicity and lipophilicity. Its methoxy group enhances solubility and metabolic stability while enabling predictable reactivity in nucleophilic substitution and transition-metal-catalyzed coupling reactions. The piperidine core functions effectively as a scaffold for bioactive molecules, particularly in CNS-targeted compounds. Bench-stable and amenable to standard purification techniques, it facilitates efficient synthesis of complex heterocyclic architectures.

Synthesis

  • Route1

    References

    • Paul; Tchelitcheff Bulletin de la Societe Chimique de France, 1947 , p. 341 344

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   21.26
  • LogP   0.3848
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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