Propacetamol hydrochlorideProduct ingredient for Propacetamol

Name
Propacetamol hydrochloride
Drug Entry
Propacetamol

Propacetamol is a non-opioid analgesic devoid of the major contraindications.1 It is a derivative of acetaminophen, or paracetamol, with the molecular formula glycine, N, N-diethyl-,4-(acetylamino)phenyl ester. Propacetamol is a parenteral formulation of paracetamol and thus, it is a prodrug that is completely hydrolyzed to paracetamol.3 It is not available in the United States but this prodrug has been widely used in other countries such as France since 1985.5

Accession Number
DBSALT001284
Structure
Synonyms
Propacetamol HCl
UNII
SH41QYH8E5
CAS Number
66532-86-3
Weight
Average: 300.78
Monoisotopic: 300.1240702
Chemical Formula
C14H21ClN2O3
InChI Key
WGTYJNGARJPYKG-UHFFFAOYSA-N
InChI
InChI=1S/C14H20N2O3.ClH/c1-4-16(5-2)10-14(18)19-13-8-6-12(7-9-13)15-11(3)17;/h6-9H,4-5,10H2,1-3H3,(H,15,17);1H
IUPAC Name
4-acetamidophenyl 2-(diethylamino)acetate hydrochloride
SMILES
Cl.CCN(CC)CC(=O)OC1=CC=C(NC(C)=O)C=C1
KEGG Drug
D08434
ChemSpider
97183
ChEMBL
CHEMBL1795480
Predicted Properties
PropertyValueSource
Water Solubility0.513 mg/mLALOGPS
logP1.96ALOGPS
logP1.42Chemaxon
logS-2.7ALOGPS
pKa (Strongest Acidic)14.67Chemaxon
pKa (Strongest Basic)6.83Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area58.64 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity74.98 m3·mol-1Chemaxon
Polarizability29.5 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon