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4-(2,2-Dimethylpropionyloxymethyl)piperidine-1-carboxylic acid t-butyl ester

HCID 68914101
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(COC(=O)C(C)(C)C)CC1
InChIKey
UXBKRTUNWZUAIP-UHFFFAOYSA-N
Molecular formula
C16H29NO4
Average molar mass
299.41 g/mol

Names & identifiers

Preferred name
4-(2,2-Dimethylpropionyloxymethyl)piperidine-1-carboxylic acid t-butyl ester
IUPAC
tert-butyl 4-(2,2-dimethylpropanoyloxymethyl)piperidine-1-carboxylate

Names & synonyms

SCHEMBL4105386UXBKRTUNWZUAIP-UHFFFAOYSA-N4-(2,2-dimethylpropionyloxymethyl)piperidine-1-carboxylic acid t-butyl ester

Database identifiers

PubChem CID
68914101

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
371

Related reactions

6 records
New reaction record
HRID 306232 reaction equation
HRID 306232As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 687970 reaction equation
HRID 687970As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1191492 reaction equation
HRID 1191492As productuspto-grants-2014_03
HRID 1191493 reaction equation
HRID 1191493As reactantuspto-grants-2014_03
HRID 1986825 reaction equation
HRID 1986825As productuspto-grants-2009_06
HRID 1986826 reaction equation
HRID 1986826As reactantuspto-grants-2009_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes