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Methyl 2-(5-cyclohexylpiperidin-3-yl)acetate (HCID 68033205)|Huagongshe
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Compound
Methyl 2-(5-cyclohexylpiperidin-3-yl)acetate
HCID
68033205
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Basic information
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Basic information
Standard SMILES
COC(=O)CC1CNCC(C2CCCCC2)C1
InChIKey
AGCIFMSDBWMASJ-UHFFFAOYSA-N
Molecular formula
C14H25NO2
Average molar mass
239.35 g/mol
Monoisotopic mass
239.18852904
Names & identifiers
Preferred name
Methyl 2-(5-cyclohexylpiperidin-3-yl)acetate
IUPAC
methyl 2-(5-cyclohexylpiperidin-3-yl)acetate
Names & synonyms
SCHEMBL10093500
Database identifiers
PubChem CID
68033205
Properties
Computed structural properties
XLogP
3
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
249
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Related reactions
1 records
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As solvent
HRID
174775
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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