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4-Amino-1-methoxy-piperidine-4-carboxylic acid methyl ester

HCID 59614587
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C1(N)CCN(OC)CC1
InChIKey
HWPRJMDRUIEWIH-UHFFFAOYSA-N
Molecular formula
C8H16N2O3
Average molar mass
188.22 g/mol

Names & identifiers

Preferred name
4-Amino-1-methoxy-piperidine-4-carboxylic acid methyl ester
IUPAC
methyl 4-amino-1-methoxypiperidine-4-carboxylate

Names & synonyms

1146245-75-1SCHEMBL245896HWPRJMDRUIEWIH-UHFFFAOYSA-NDB-195355methyl 4-amino-1-methoxypiperidine-4-carboxylate4-Amino-1-methoxy-4-piperidinecarboxylic acid methyl ester4-amino-1-methoxy-piperidine-4-carboxylic acid methyl ester

Database identifiers

PubChem CID
59614587

Properties

Computed structural propertiesFilling in

XLogP
-0.4
Topological polar surface area
64.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
188

Related reactions

3 records
New reaction record
HRID 814055 reaction equation
HRID 814055As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1151616 reaction equation
HRID 1151616As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1546317 reaction equation
HRID 1546317As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes