dipipanone   Click here for help

GtoPdb Ligand ID: 9081

Synonyms: Diconal tablets (dipipanone+cyclizine) | pipadone
Approved drug
dipipanone is an approved drug (UK (2003))
Compound class: Synthetic organic
Comment: Dipipanone is a strong opioid analgesic drug. The INN record specifies a mixture of enantiomers. We show the non-stereo molecule to represent the mixture.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 20.31
Molecular weight 349.24
XLogP 5.46
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES CCC(=O)C(c1ccccc1)(c1ccccc1)CC(N1CCCCC1)C
Isomeric SMILES CCC(=O)C(c1ccccc1)(c1ccccc1)CC(N1CCCCC1)C
InChI InChI=1S/C24H31NO/c1-3-23(26)24(21-13-7-4-8-14-21,22-15-9-5-10-16-22)19-20(2)25-17-11-6-12-18-25/h4-5,7-10,13-16,20H,3,6,11-12,17-19H2,1-2H3
InChI Key SVDHSZFEQYXRDC-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (UK (2003))
IUPAC Name Click here for help
4,4-di(phenyl)-6-piperidin-1-ylheptan-3-one
International Nonproprietary Names Click here for help
INN number INN
465 dipipanone
Synonyms Click here for help
Diconal tablets (dipipanone+cyclizine) | pipadone
Database Links Click here for help
CAS Registry No. 467-83-4
ChEMBL Ligand CHEMBL2111157
DrugBank Ligand DB01491
DrugCentral Ligand 921
GtoPdb PubChem SID 315661166
PubChem CID 13331
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Wikipedia Dipipanone