1.0 2010-04-08 22:14:31 UTC 2015-07-21 06:37:49 UTC FDB019697 2,3,4,5-Tetrahydro-6-(5-methyl-2-furanyl)pyridine Proline-derived Maillard product 2-(5-Methyl-2-furyl)-3,4,5,6-tetrahydropyridine C10H13NO 163.2163 163.099714043 6-(5-methylfuran-2-yl)-2,3,4,5-tetrahydropyridine 2-(5-methylfuran-2-yl)-3,4,5,6-tetrahydropyridine 104704-35-0 CC1=CC=C(O1)C1=NCCCC1 InChI=1S/C10H13NO/c1-8-5-6-10(12-8)9-4-2-3-7-11-9/h5-6H,2-4,7H2,1H3 WARIRIKWLUUAPJ-UHFFFAOYSA-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 Aromatic heteromonocyclic compounds Azacyclic compounds Furans Heteroaromatic compounds Hydrocarbon derivatives Ketimines Organooxygen compounds Organopnictogen compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Aromatic heteromonocyclic compound Azacycle Furan Heteroaromatic compound Hydrocarbon derivative Imine Ketimine Organic 1,3-dipolar compound Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Propargyl-type 1,3-dipolar organic compound Tetrahydropyridine logp 2.80 ALOGPS logs -3.08 ALOGPS solubility 1.35e-01 g/l ALOGPS logp 1.7 ChemAxon pka_strongest_basic 4.5 ChemAxon iupac 6-(5-methylfuran-2-yl)-2,3,4,5-tetrahydropyridine ChemAxon average_mass 163.2163 ChemAxon mono_mass 163.099714043 ChemAxon smiles CC1=CC=C(O1)C1=NCCCC1 ChemAxon formula C10H13NO ChemAxon inchi InChI=1S/C10H13NO/c1-8-5-6-10(12-8)9-4-2-3-7-11-9/h5-6H,2-4,7H2,1H3 ChemAxon inchikey WARIRIKWLUUAPJ-UHFFFAOYSA-N ChemAxon polar_surface_area 25.5 ChemAxon refractivity 48.45 ChemAxon polarizability 19 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13856 Specdb::CMs 136800 Specdb::CMs 144534 Specdb::MsIr 8482 Specdb::MsIr 8483 Specdb::MsMs 296560 Specdb::MsMs 296561 Specdb::MsMs 296562 Specdb::MsMs 337888 Specdb::MsMs 337889 Specdb::MsMs 337890 Specdb::MsMs 2340291 Specdb::MsMs 2340292 Specdb::MsMs 2340293 Specdb::MsMs 2625218 Specdb::MsMs 2625219 Specdb::MsMs 2625220 HMDB40015 #<Reference:0x000055ce31d164b0>