Ketobemidone hydrochlorideProduct ingredient for Ketobemidone

Name
Ketobemidone hydrochloride
Drug Entry
Ketobemidone

Ketobemidone is a powerful opioid analgesic. It also has some NMDA-antagonist properties. This makes it useful for some types of pain that don't respond well to other opioids. The most commonly cited equalisation ratio for analgesic doses is 25 mg of ketobemidone hydrobromide to 60 mg of morphine hydrochloride or sulfate and circa 8 mg of ketobemidone by injection.

Accession Number
DBSALT000189
Structure
Synonyms
Ketobemidone HCl
UNII
U9U6LTV80K
CAS Number
5965-49-1
Weight
Average: 283.8
Monoisotopic: 283.1339067
Chemical Formula
C15H22ClNO2
InChI Key
HYDFAZFVKRXNJX-UHFFFAOYSA-N
InChI
InChI=1S/C15H21NO2.ClH/c1-3-14(18)15(7-9-16(2)10-8-15)12-5-4-6-13(17)11-12;/h4-6,11,17H,3,7-10H2,1-2H3;1H
IUPAC Name
1-[4-(3-hydroxyphenyl)-1-methylpiperidin-4-yl]propan-1-one hydrochloride
SMILES
Cl.CCC(=O)C1(CCN(C)CC1)C1=CC(O)=CC=C1
Human Metabolome Database
HMDB0041913
KEGG Compound
C11792
PubChem Compound
10101
ChemSpider
72319
ChEBI
6125
ChEMBL
CHEMBL47072
Predicted Properties
PropertyValueSource
Water Solubility3.01 mg/mLALOGPS
logP2.01ALOGPS
logP2.49Chemaxon
logS-1.9ALOGPS
pKa (Strongest Acidic)9.44Chemaxon
pKa (Strongest Basic)8.09Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area40.54 Å2Chemaxon
Rotatable Bond Count3Chemaxon
Refractivity73.12 m3·mol-1Chemaxon
Polarizability27.83 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon