(1,3-dimethyl-4-phenylpiperidin-4-yl) propanoate (CED0060897)

Record Information
Version1.0
Creation Date2026-08-19 17:06:44 UTC
Update Date2026-08-19 17:06:44 UTC
Accession NumberCHEM190017
Identification
Common Name(1,3-dimethyl-4-phenylpiperidin-4-yl) propanoate
ClassSmall Molecule
Description
(1,3-dimethyl-4-phenylpiperidin-4-yl) propanoate is an organic compound with the chemical formula C16H23NO2 and an average molecular weight of 261.36 g/mol. (1,3-dimethyl-4-phenylpiperidin-4-yl) propanoate belongs to the phenylpiperidines, a subclass of piperidines within the organic compounds. This organoheterocyclic compound has been identified in or released from four recorded sources. These include electrical and electronic equipment, specifically electric switches and electrically stimulated smoking devices. It is also associated with food preservation within food, food processing, and cookware categories, as well as non-electric simulated smoking devices found in household cleaning and consumer products.
Contaminant TypeNot Available
Chemical Structure
SynonymsNot Available
Chemical FormulaC16H23NO2
Average Molecular Mass261.360 g/mol
Monoisotopic Mass261.173 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C16H23NO2/c1-4-15(18)19-16(14-8-6-5-7-9-14)10-11-17(3)12-13(16)2/h5-9,13H,4,10-12H2,1-3H3
InChI KeyUVAZQQHAVMNMHE-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity ValuesNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
517Electric SwitchesElectrical & Electronic EquipmentNot Available
518Electrically Stimulated Smoking DevicesElectrical & Electronic EquipmentNot Available
545Food PreservationFood, food processing & cookwareNot Available
559Non Electric Simulated Smoking DevicesHousehold cleaning & consumer productsNot Available
580Manufacture Preparation Of Tobacco ProductsIndustrial manufacturing & chemical processingNot Available
610Aftersun ProductsPersonal care & cosmeticsNot Available
632ApparelTextiles, leather & furnishingsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Mu-type opioid receptor structureClick to view 3D structureMu-type opioid receptorP35372HumansPredicted (SEA)174.46
Click to view 3D structureMu-type opioid receptorP33535Rattus norvegicusPredicted (SEA)169.633
Click to view 3D structureSodium-dependent serotonin transporterP31652Rattus norvegicusPredicted (SEA)66.7946
Kappa-type opioid receptor structureClick to view 3D structureKappa-type opioid receptorP41145HumansPredicted (SEA)220.703
Click to view 3D structureD(2) dopamine receptorP61169RatPredicted (SEA)168.544
Click to view 3D structureMu-type opioid receptorP97266Cavia porcellusPredicted (SEA)218.756
Delta-type opioid receptor structureClick to view 3D structureDelta-type opioid receptorP41143HumansPredicted (SEA)283.527
Click to view 3D structureSodium-dependent dopamine transporterP23977Rattus norvegicusPredicted (SEA)71.0763
Click to view 3D structureKappa-type opioid receptorP41144Cavia porcellusPredicted (SEA)222.727
Voltage-gated inwardly rectifying potassium channel KCNH2 structureClick to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH2Q12809HumansPredicted (SEA)908.578
Sigma non-opioid intracellular receptor 1 structureClick to view 3D structureSigma non-opioid intracellular receptor 1Q99720HumansPredicted (SEA)416.338
Click to view 3D structureSigma non-opioid intracellular receptor 1Q60492Cavia porcellusPredicted (SEA)278.622
Click to view 3D structureMu-type opioid receptorP42866Mus musculusPredicted (SEA)204.899
Click to view 3D structureMuscarinic acetylcholine receptor M1P08482Rattus norvegicusPredicted (SEA)54.1052
Click to view 3D structureD(1A) dopamine receptorP18901Rattus norvegicusPredicted (SEA)190.808
Click to view 3D structureSigma non-opioid intracellular receptor 1Q9R0C9Rattus norvegicusPredicted (SEA)206.145
CXXC-type zinc finger protein 5 structureClick to view 3D structureCXXC-type zinc finger protein 5Q7LFL8HumansPredicted (SEA)4.20386
Sodium-dependent serotonin transporter structureClick to view 3D structureSodium-dependent serotonin transporterP31645HumansPredicted (SEA)534.668
Muscarinic acetylcholine receptor M3 structureClick to view 3D structureMuscarinic acetylcholine receptor M3P20309HumansPredicted (SEA)254.256
Click to view 3D structureMuscarinic acetylcholine receptor M2P10980Rattus norvegicusPredicted (SEA)50.2906
Click to view 3D structureDelta-type opioid receptorP33533Rattus norvegicusPredicted (SEA)349.076
Muscarinic acetylcholine receptor M5 structureClick to view 3D structureMuscarinic acetylcholine receptor M5P08912HumansPredicted (SEA)262.274
Muscarinic acetylcholine receptor M1 structureClick to view 3D structureMuscarinic acetylcholine receptor M1P11229HumansPredicted (SEA)418.05
Click to view 3D structureAP-4 complex subunit sigma-1Q9Y587HumansPredicted (SEA)10.4318
Substance-P receptor structureClick to view 3D structureSubstance-P receptorP25103HumansPredicted (SEA)356.004
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available