1.0 2010-04-08 22:09:37 UTC 2019-11-26 03:04:53 UTC FDB011393 2-(1-Propenyl)-delta1-piperideine Isolated from pomegranate (leaves). 2-(1-Propenyl)-delta1-piperideine is found in fruits. 2-(1-Propenyl)-D1-piperideine C8H13N 123.1955 123.104799421 6-[(1Z)-prop-1-en-1-yl]-2,3,4,5-tetrahydropyridine 2-[(1Z)-prop-1-en-1-yl]-3,4,5,6-tetrahydropyridine 16543-92-3 C\C=C/C1=NCCCC1 InChI=1S/C8H13N/c1-2-5-8-6-3-4-7-9-8/h2,5H,3-4,6-7H2,1H3/b5-2- SOEACRLLVZHBKW-DJWKRKHSSA-N belongs to the class of organic compounds known as tetrahydropyridines. These are derivatives of pyridine in which two double bonds in the pyridine moiety are reduced by adding four hydrogen atoms. Tetrahydropyridines Organic compounds Organoheterocyclic compounds Pyridines and derivatives Hydropyridines Aliphatic heteromonocyclic compounds Azacyclic compounds Hydrocarbon derivatives Ketimines Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Aliphatic heteromonocyclic compound Azacycle Hydrocarbon derivative Imine Ketimine Organic 1,3-dipolar compound Organic nitrogen compound Organonitrogen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Tetrahydropyridine logp 3.20 ALOGPS logs -2.52 ALOGPS solubility 3.72e-01 g/l ALOGPS melting_point Mp 112-114° (hydrochloride) logp 2.16 ChemAxon pka_strongest_basic 8.14 ChemAxon iupac 6-[(1Z)-prop-1-en-1-yl]-2,3,4,5-tetrahydropyridine ChemAxon average_mass 123.1955 ChemAxon mono_mass 123.104799421 ChemAxon smiles C\C=C/C1=NCCCC1 ChemAxon formula C8H13N ChemAxon inchi InChI=1S/C8H13N/c1-2-5-8-6-3-4-7-9-8/h2,5H,3-4,6-7H2,1H3/b5-2- ChemAxon inchikey SOEACRLLVZHBKW-DJWKRKHSSA-N ChemAxon polar_surface_area 12.36 ChemAxon refractivity 40.97 ChemAxon polarizability 15 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 6062 Specdb::MsIr 6063 Specdb::CMs 19613 Specdb::CMs 171034 Specdb::MsMs 66558 Specdb::MsMs 66559 Specdb::MsMs 66560 Specdb::MsMs 124158 Specdb::MsMs 124159 Specdb::MsMs 124160 Specdb::MsMs 2295818 Specdb::MsMs 2295819 Specdb::MsMs 2295820 Specdb::MsMs 2642928 Specdb::MsMs 2642929 Specdb::MsMs 2642930 HMDB33365 #<Reference:0x000055ce330e79f8> Fruits Unknown generic