Primaquine

C₁₅H₂₁N₃OCAS 90-34-6259.35 g/mol

Open in Covalent MOL file

Ether Primary amine Secondary amine

Properties

Molecular formula: C₁₅H₂₁N₃O
Molar mass: 259.35 g/mol
Exact mass: 259.1685 Da
Melting point: below 25 °C
Boiling point: 177 °C
logP: 2.78Crippen estimate
Polar surface area: 60.2 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 6

Identifiers

CAS number

90-34-6

SMILES

COc1cc(NC(C)CCCN)c2ncccc2c1

InChIKey

INDBQLZJXZLFIT-UHFFFAOYSA-N

InChI

InChI=1S/C15H21N3O/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14/h4,6,8-11,18H,3,5,7,16H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

20 names · show all

1,4-Pentanediamine, N4-(6-methoxy-8-quinolinyl)-
Quinoline, 8-[(4-amino-1-methylbutyl)amino]-6-methoxy-
N4-(6-Methoxy-8-quinolinyl)-1,4-pentanediamine
SN 13272
8-(4-Amino-1-methylbutylamino)-6-methoxyquinoline
6-Methoxy-8-[4-amino-1-methylbutylamino]quinoline
Primachin
neo-Quipenyl
Primaquin
WR 2975
(±)-Primaquine
Dl-Primaquine
NSC 27296
Maliride
Malirid
Primacip
Primalex
Leoprime
Pimaquin
1,4-Pentanediamine N4-(6-methoxy-8-quinolinyl)-

Work with Primaquine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Primaquine diphosphate63-45-683 % similar 6-Methoxy-8-aminoquinoline90-52-850 % similar 6-Methoxyquinoline5263-87-638 % similar 6-Bromo-8-methoxyquinoline103028-32-636 % similar 3-(4-Methoxy-phenoxy)-propylamine100841-00-735 % similar 8-Methoxyquinoline938-33-035 % similar Chloroquine54-05-731 % similar 3-Methoxyphenethylamine2039-67-031 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook