Procaine hydrochlorideProduct ingredient for Procaine

Name
Procaine hydrochloride
Drug Entry
Procaine

A local anesthetic of the ester type that has a slow onset and a short duration of action. It is mainly used for infiltration anesthesia, peripheral nerve block, and spinal block. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1016). Procaine has also been investigated as an oral entry inhibitor in treatment-experienced HIV patients 2.

Accession Number
DBSALT000551
Structure
Synonyms
Procaine HCl
External IDs
SP-01A / SP01A
UNII
95URV01IDQ
CAS Number
51-05-8
Weight
Average: 272.771
Monoisotopic: 272.129155633
Chemical Formula
C13H21ClN2O2
InChI Key
HCBIBCJNVBAKAB-UHFFFAOYSA-N
InChI
InChI=1S/C13H20N2O2.ClH/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;/h5-8H,3-4,9-10,14H2,1-2H3;1H
IUPAC Name
2-(diethylamino)ethyl 4-aminobenzoate hydrochloride
SMILES
Cl.CCN(CC)CCOC(=O)C1=CC=C(N)C=C1
KEGG Compound
C07894
PubChem Compound
5795
ChemSpider
5591
ChEBI
8431
ChEMBL
CHEMBL1200841
Wikipedia
Procaine
Predicted Properties
PropertyValueSource
Water Solubility6.81 mg/mLALOGPS
logP2.1ALOGPS
logP1.88Chemaxon
logS-1.5ALOGPS
pKa (Strongest Basic)8.96Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area55.56 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity70.3 m3·mol-1Chemaxon
Polarizability27.33 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon