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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL15487
CHEMBL15487
Compound Name PIPERIDINE
ChEMBL Synonyms PIPERIDINE | PIPERIDINE PHOSPHATE | CYPENTIL
Max Phase 0
Trade Names
Molecular Formula C5H11N

Additional synonyms for CHEMBL15487 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C1CCNCC1
Standard InChI InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2
Standard InChI Key NQRYJNQNLNOLGT-UHFFFAOYSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL15487

Molecule Features

CHEMBL15487 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
85.2 85.0891 0.7 0 12.03 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
1 1 0 1 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 10.45 .61 -2.16 0 6 0.46

Structural Alerts

There are no structural alerts for CHEMBL15487

Compound Cross References

ChemSpider ChemSpider:NQRYJNQNLNOLGT-UHFFFAOYSA-N
PubChem SID: 144208373
Wikipedia Piperidine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL15487



ACToR 110-89-4
BindingDB 50026449
ChEBI 18049
eMolecules 477538
EPA CompTox Dashboard DTXSID6021165
FDA SRS 67I85E138Y
Guide to Pharmacology 5477
Human Metabolome Database HMDB34301
IBM Patent System CE825FC9F9EE17DA5CC349BE94884DA7
KEGG Ligand C01746
Mcule MCULE-4094049864
MolPort MolPort-000-871-527
Nikkaji J2.884C
NMRShiftDB 10008705
PDBe PIP
PubChem 8082
PubChem: Thomson Pharma 14747353
SureChEMBL SCHEMBL427

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/NQRYJNQNLNOLGT-UHFFFAOYSA-N spacer
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