Responsive image

Common name


Chloroquine

IUPAC name


7-chloro-N-[5-(diethylamino)pentan-2-yl]quinolin-4-amine

SMILES


CCN(CC)CCCC(C)NC1=C2C=CC(Cl)=CC2=NC=C1

Compound class


Antirheumatic Agents; Antimalarials; Antiprotozoal Agents; Amebicides; Antiparasitic Products, Insecticides and Repellents; Aminoquinolines; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP2C8 Inducers; CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors;

Therapeutic area


For the suppressive treatment and for acute attacks of malaria due to P. vivax, P.malariae, P. ovale, and susceptible strains of P. falciparum, Second-line agent in treatment of Rheumatoid Arthritis.

Common name


Chloroquine

IUPAC name


7-chloro-N-[5-(diethylamino)pentan-2-yl]quinolin-4-amine

SMILES


CCN(CC)CCCC(C)NC1=C2C=CC(Cl)=CC2=NC=C1

INCHI


InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)

FORMULA


C18H26ClN3

Responsive image

Common name


Chloroquine

IUPAC name


7-chloro-N-[5-(diethylamino)pentan-2-yl]quinolin-4-amine

Molecular weight


319.872

clogP


4.322

clogS


-6.161

HBond Acceptor


2

HBond Donor


1

Total Polar
Surface Area


28.16

Number of Rings


2

Rotatable Bond


8

Drug ID Common name Structure CAS SMILE Frequency
FDBF00070 N-ethylethanamine Responsive image N(CC)CC 0.0240
FDBF00081 pentane Responsive image CCCCC 0.0316
FDBF00208 propan-2-amine Responsive image CC(N)C 0.0210
FDBF00696 N,N-diethylethanamine Responsive image C(C)N(CC)CC 0.0079
FDBF01334 (2S)-butan-2-amine Responsive image CCC(N)C 0.0010
15 , 2