1-(3-piperidin-1-ylpropyl)piperidine (CED0241559)

Record Information
Version1.0
Creation Date2026-08-28 03:26:30 UTC
Update Date2026-08-28 03:26:30 UTC
SynCED IDCED0241559
Secondary Accession Numbers
  • CHEM285772
Identification
Common Name1-(3-piperidin-1-ylpropyl)piperidine
ClassSmall Molecule
Description
1-(3-piperidin-1-ylpropyl)piperidine belongs to the piperidines, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C13H26N2 and an average molecular weight of 210.36 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC13H26N2
Average Molecular MassNot Available
Monoisotopic Mass210.210 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESC1CCN(CC1)CCCN2CCCCC2
InChI IdentifierInChI=1S/C13H26N2/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-13H2
InChI KeyAMBFNDRKYCJLNH-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
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
363.0 Log mg/kg [200:650]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000511Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.Electrical & Electronic EquipmentPubChem
CEDs000519Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.Electrical & Electronic EquipmentPubChem
CEDs000524Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.Electrical & Electronic EquipmentPubChem
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000614Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.Personal care & cosmeticsPubChem
CEDs000662Yarns Or Threads?Yarns or threads used in textiles can be a source of synthetic chemical contamination due to the production processes and treatments they undergo.Textiles, leather & furnishingsPubChem
CEDs000691Non Oxide Glass?Non-oxide glass refers to a category of glasses primarily composed of materials other than silicon dioxide, such as boron oxide or phosphorous oxide.Building & ConstructionPubChem
CEDs000696Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.Industrial manufacturing & chemical processingPubChem
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsPubChem
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureSigma non-opioid intracellular receptor 1Q60492Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.407
Applicability Domain
0.423
Statistical Significance
0.0062
Supporting Reference Compounds
229
E-value
48.5779
Histamine H3 receptor structureClick to view 3D structureHistamine H3 receptorQ9Y5N1HumansPredicted (SEA)
Prediction Confidence Score
0.404
Applicability Domain
0.419
Statistical Significance
0.005
Supporting Reference Compounds
294
E-value
39.1582
Click to view 3D structureSigma intracellular receptor 2Q5U3Y7Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.374
Applicability Domain
0.406
Statistical Significance
0.0048
Supporting Reference Compounds
110
E-value
37.2119
Histamine H1 receptor structureClick to view 3D structureHistamine H1 receptorP35367HumansPredicted (SEA)
Prediction Confidence Score
0.367
Applicability Domain
0.406
Statistical Significance
0.0148
Supporting Reference Compounds
507
E-value
115.139
Click to view 3D structureHistamine H3 receptorQ9QYN8Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.367
Applicability Domain
0.419
Statistical Significance
0.0033
Supporting Reference Compounds
80
E-value
25.6124
Sigma non-opioid intracellular receptor 1 structureClick to view 3D structureSigma non-opioid intracellular receptor 1Q99720HumansPredicted (SEA)
Prediction Confidence Score
0.362
Applicability Domain
0.423
Statistical Significance
0.0217
Supporting Reference Compounds
562
E-value
168.777
Voltage-gated inwardly rectifying potassium channel KCNH2 structureClick to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH2Q12809HumansPredicted (SEA)
Prediction Confidence Score
0.35
Applicability Domain
0.406
Statistical Significance
0.0637
Supporting Reference Compounds
1498
E-value
495.822
Click to view 3D structureCholinesteraseP81908Equus caballusPredicted (SEA)
Prediction Confidence Score
0.344
Applicability Domain
0.406
Statistical Significance
0.0115
Supporting Reference Compounds
201
E-value
89.2152
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.336
Applicability Domain
0.419
Statistical Significance
0.048
Supporting Reference Compounds
1103
E-value
373.365
Click to view 3D structureSigma non-opioid intracellular receptor 1Q9R0C9Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.33
Applicability Domain
0.423
Statistical Significance
0.0117
Supporting Reference Compounds
207
E-value
91.395
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP28223HumansPredicted (SEA)
Prediction Confidence Score
0.328
Applicability Domain
0.419
Statistical Significance
0.0477
Supporting Reference Compounds
955
E-value
371.574
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansPredicted (SEA)
Prediction Confidence Score
0.325
Applicability Domain
0.419
Statistical Significance
0.024
Supporting Reference Compounds
406
E-value
186.605
5-hydroxytryptamine receptor 7 structureClick to view 3D structure5-hydroxytryptamine receptor 7P34969HumansPredicted (SEA)
Prediction Confidence Score
0.316
Applicability Domain
0.371
Statistical Significance
0.0361
Supporting Reference Compounds
565
E-value
281.036
Histamine H4 receptor structureClick to view 3D structureHistamine H4 receptorQ9H3N8HumansPredicted (SEA)
Prediction Confidence Score
0.316
Applicability Domain
0.406
Statistical Significance
0.0107
Supporting Reference Compounds
150
E-value
83.2208
Click to view 3D structureAlpha-1B adrenergic receptorP15823Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.315
Applicability Domain
0.419
Statistical Significance
0.0091
Supporting Reference Compounds
130
E-value
71.0763
Amine oxidase [flavin-containing] B structureClick to view 3D structureAmine oxidase [flavin-containing] BP27338HumansPredicted (SEA)
Prediction Confidence Score
0.313
Applicability Domain
0.342
Statistical Significance
0.0264
Supporting Reference Compounds
315
E-value
205.444
Click to view 3D structureHistamine H1 receptorP31389Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.313
Applicability Domain
0.361
Statistical Significance
0.0111
Supporting Reference Compounds
101
E-value
86.4126
Transient receptor potential cation channel subfamily V member 3 structureClick to view 3D structureTransient receptor potential cation channel subfamily V member 3Q8K424Mus musculusPredicted (SEA)
Prediction Confidence Score
0.308
Applicability Domain
0.308
Statistical Significance
0.004
Supporting Reference Compounds
1
E-value
30.8283
Muscarinic acetylcholine receptor M5 structureClick to view 3D structureMuscarinic acetylcholine receptor M5P08912HumansPredicted (SEA)
Prediction Confidence Score
0.307
Applicability Domain
0.419
Statistical Significance
0.0153
Supporting Reference Compounds
266
E-value
118.954
Muscarinic acetylcholine receptor M4 structureClick to view 3D structureMuscarinic acetylcholine receptor M4P08173HumansPredicted (SEA)
Prediction Confidence Score
0.303
Applicability Domain
0.419
Statistical Significance
0.019
Supporting Reference Compounds
297
E-value
147.602
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)
Prediction Confidence Score
0.3
Applicability Domain
0.419
Statistical Significance
0.0707
Supporting Reference Compounds
861
E-value
550.472
Click to view 3D structureAcetylcholinesteraseO42275Electrophorus electricusPredicted (SEA)
Prediction Confidence Score
0.298
Applicability Domain
0.406
Statistical Significance
0.0253
Supporting Reference Compounds
206
E-value
197.348
Sodium-dependent serotonin transporter structureClick to view 3D structureSodium-dependent serotonin transporterP31645HumansPredicted (SEA)
Prediction Confidence Score
0.298
Applicability Domain
0.375
Statistical Significance
0.0526
Supporting Reference Compounds
593
E-value
409.72
Click to view 3D structureHistamine H3 receptorQ9JI35Cavia porcellusPredicted (SEA)
Prediction Confidence Score
0.29
Applicability Domain
0.382
Statistical Significance
0.0075
Supporting Reference Compounds
56
E-value
58.2312
Click to view 3D structure5-hydroxytryptamine receptor 1AP19327Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.289
Applicability Domain
0.394
Statistical Significance
0.0682
Supporting Reference Compounds
541
E-value
531.165
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available