Cyclopentolate hydrochlorideProduct ingredient for Cyclopentolate

Name
Cyclopentolate hydrochloride
Drug Entry
Cyclopentolate

A parasympatholytic anticholinergic used solely to obtain mydriasis or cycloplegia.

Accession Number
DBSALT000476
Structure
Thumb
Synonyms
Cyclopentolate HCl
UNII
736I6971TE
CAS Number
5870-29-1
Weight
Average: 327.846
Monoisotopic: 327.16012141
Chemical Formula
C17H26ClNO3
InChI Key
RHKZVMUBMXGOLL-UHFFFAOYSA-N
InChI
InChI=1S/C17H25NO3.ClH/c1-18(2)12-13-21-16(19)15(14-8-4-3-5-9-14)17(20)10-6-7-11-17;/h3-5,8-9,15,20H,6-7,10-13H2,1-2H3;1H
IUPAC Name
2-(dimethylamino)ethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate hydrochloride
SMILES
Cl.CN(C)CCOC(=O)C(C1=CC=CC=C1)C1(O)CCCC1
External Links
PubChem Compound
22162
ChemSpider
20805
ChEMBL
CHEMBL1200473
Wikipedia
Cyclopentolate
Predicted Properties
PropertyValueSource
Water Solubility1.5 mg/mLALOGPS
logP2.09ALOGPS
logP2.32ChemAxon
logS-2.3ALOGPS
pKa (Strongest Acidic)14.19ChemAxon
pKa (Strongest Basic)8.42ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count3ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area49.77 Å2ChemAxon
Rotatable Bond Count7ChemAxon
Refractivity82.81 m3·mol-1ChemAxon
Polarizability32.66 Å3ChemAxon
Number of Rings2ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon