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CS-W001157 4
Total: USD 88.00

tert-Butyl 1,6-diazaspiro[3.5]nonane-1-carboxylate

  • CAS No. 1251005-45-4

  • Cat. No. CS-0048491
  • Purity≥97%
  • MDL No.None

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

tert-Butyl 1,6-diazaspiro[3.5]nonane-1-carboxylate|CS-0048491

Structure of 1251005-45-4

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General Information

  • CAS No. 1251005-45-4
  • Cat. No. CS-0048491
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂N₂O₂
  • Molecular Weight 226.32
  • Synonym(s) 1-Boc-1,6-diaza-spiro[3.5]nonane
  • SMILES CC(C)(C)OC(=O)N1CCC11CCCNC1

Description

tert-Butyl 1,6-diazaspiro[3.5]nonane-1-carboxylate features a rigid spirocyclic scaffold with two nitrogen atoms at the 1- and 6-positions, offering enhanced conformational control. The tert-butyl ester group provides stability and ease of handling, enabling straightforward deprotection under mild acidic conditions. This compound serves as a valuable building block in medicinal chemistry for constructing constrained heterocyclic motifs.

Application

tert-Butyl 1,6-diazaspiro[3.5]nonane-1-carboxylate serves as a versatile scaffold for constructing spirocyclic amine libraries, enabling efficient access to constrained piperazine analogs. The tert-butyl carbamate group offers excellent bench stability and facilitates straightforward deprotection under mild acidic conditions. Its dual nitrogen atoms provide orthogonal reactivity for selective functionalization, making it well-suited for medicinal chemistry campaigns targeting CNS-directed therapeutics and kinase inhibitors.

Safety Information

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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

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   1.7494
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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