Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate

Name: Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate
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CAS No. 887587-18-0
Cat. No. CS-0461006
Purity≥97%
MDL No.MFCD07367784

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Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate|CS-0461006

Structure of 887587-18-0

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General Information

CAS No. 887587-18-0
Cat. No. CS-0461006
Purity ≥97%
MDL No. MFCD07367784
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₅H₂₇N₃O₃
Molecular Weight 297.40
Synonym(s) None
SMILES O=C(OC(C)(C)C)N1CCC(C(=O)N2CCNCC2)CC1

Description

Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate is a bifunctional building block featuring a piperazine ring tethered to a piperidine core via a carbonyl linker. This structure integrates a protected amine and a flexible, electron-rich heterocyclic system, enabling efficient incorporation into complex scaffolds. The tert-butyl ester group offers stability under basic conditions while permitting straightforward deprotection. The molecule's solubility in common organic solvents and robustness in multistep synthesis streamline its use in medicinal chemistry campaigns targeting CNS-active compounds and kinase inhibitors.

Application

Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate serves as a versatile bifunctional building block in medicinal chemistry, enabling efficient construction of complex piperazine-containing scaffolds. The tert-butyl carbamate group provides excellent bench stability and facilitates straightforward deprotection under mild acidic conditions. The piperazine moiety offers multiple points for functionalization, while the piperidine core supports diverse transformations, including alkylation, acylation, and transition-metal-catalyzed coupling reactions, making it ideal for library synthesis and lead optimization workflows.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 61.88
LogP 1.0653
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Piperazine compounds

Key Words

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Tert-butyl 4-(piperazine-1-carbonyl)piperidine-1-carboxylate

CAS No. 887587-18-0

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