3-(1-Hydroxybutyl)-5-propylindolizidine; (3R*,5R*,9R*,10S*)-form 

AlkaPlorer ID: AK301019

Synonym: Quinolizidine 239Q

IUPAC Name: 1-(5-propyl-1,2,3,5,6,7,8,8a-octahydroindolizin-3-yl)butan-1-ol

Structure

SMILES: CCCC(O)C1CCC2CCCC(CCC)N21

copy

InChI: InChI=1S/C15H29NO/c1-3-6-12-8-5-9-13-10-11-14(16(12)13)15(17)7-4-2/h12-15,17H,3-11H2,1-2H3

copy

InChIKey: VCPUIRJMEQYAAE-UHFFFAOYSA-N

copy

Reference

CAS: 1111086-61-3

Properties Information

Molecule Weight: 239.403

TPSA: 23.47

MolLogP: 3.333000000000002

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information