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Ethyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate

HCID 1164515
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
768290-38-6
Standard SMILES
CCOC(=O)C1CCN(C(=O)C(C)(C)C)CC1
InChIKey
IIRMPFJXCCCLAP-UHFFFAOYSA-N
Molecular formula
C13H23NO3
Average molar mass
241.33 g/mol
Monoisotopic mass
241.1677936

Names & identifiers

Preferred name
Ethyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate
IUPAC
ethyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate

Names & synonyms

ethyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate768290-38-6BAS 03589643SCHEMBL1572674DTXSID70360789IIRMPFJXCCCLAP-UHFFFAOYSA-NHMS5162A04STK175613AKOS000650849ethyl 1-pivaloylpiperidine-4-carboxylateDB-200784ST50272770
Show more names
SR-01000324219SR-01000324219-11-(2,2-Dimethyl-1-oxopropyl)-4-piperidinecarboxylic acid ethyl ester

Database identifiers

CAS
768290-38-6
PubChem CID
1164515
DTXSID
DTXSID70360789

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
286

Related reactions

5 records
New reaction record
HRID 12396 reaction equation
HRID 12396As productuspto-grants-2010_06
HRID 12397 reaction equation
HRID 12397As reactantuspto-grants-2010_06
HRID 101073 reaction equation
HRID 101073As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 2192226 reaction equation
HRID 2192226As productuspto-grants-2012_12
HRID 2192227 reaction equation
HRID 2192227As reactantuspto-grants-2012_12

Compound notes

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