HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

1-Benzyl-4-tert-butyl-piperazine

HCID 3591937
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)N1CCN(Cc2ccccc2)CC1
InChIKey
NGFMWJQBLQMURA-UHFFFAOYSA-N
Molecular formula
C15H24N2
Average molar mass
232.36 g/mol

Names & identifiers

Preferred name
1-Benzyl-4-tert-butyl-piperazine
IUPAC
1-benzyl-4-tert-butylpiperazine

Names & synonyms

1-benzyl-4-tert-butyl-piperazine1-benzyl-4-tert-butylpiperazine40489-73-4SCHEMBL8552341-benzyl-4-tert-butyl piperazineNGFMWJQBLQMURA-UHFFFAOYSA-NDB-311845

Database identifiers

PubChem CID
3591937
Nikkaji
J3.632.993I

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
218

Related reactions

3 records
New reaction record
HRID 298934 reaction equation
HRID 298934As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1657753 reaction equation
HRID 1657753As productuspto-grants-1976_06
HRID 1657754 reaction equation
HRID 1657754As reactantuspto-grants-1976_06

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes