Cyclopentamine hydrochlorideProduct ingredient for Cyclopentamine

Name
Cyclopentamine hydrochloride
Drug Entry
Cyclopentamine

Cyclopentamine is a sympathomimetic alkylamine, classified as a vasoconstrictor. Cyclopentamine was an over the counter treatment for nasal congestion in Europe and Australia. It has been widely discontinued due to the safety, effectiveness, and availability of a similar drug, propylhexedrine.

Accession Number
DBSALT002451
Structure
Synonyms
Cyclopentamine HCl
UNII
F551446KF3
CAS Number
538-02-3
Weight
Average: 177.72
Monoisotopic: 177.1284273
Chemical Formula
C9H20ClN
InChI Key
XGZPRABQSGUFBL-UHFFFAOYSA-N
InChI
InChI=1S/C9H19N.ClH/c1-8(10-2)7-9-5-3-4-6-9;/h8-10H,3-7H2,1-2H3;1H
IUPAC Name
(1-cyclopentylpropan-2-yl)(methyl)amine hydrochloride
SMILES
Cl.CNC(C)CC1CCCC1
ChemSpider
83770
ChEMBL
CHEMBL2107277
Predicted Properties
PropertyValueSource
Water Solubility0.476 mg/mLALOGPS
logP2.86ALOGPS
logP2.26Chemaxon
logS-2.5ALOGPS
pKa (Strongest Basic)10.61Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count1Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area12.03 Å2Chemaxon
Rotatable Bond Count3Chemaxon
Refractivity44.93 m3·mol-1Chemaxon
Polarizability18.43 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon