1.0 2016-10-03 18:33:54 UTC 2020-04-22 15:48:57 UTC BMDB0012189 BMDB12189 Aminopropylcadaverine 3-Apcad N-(3-Aminopropyl)-1,5-pentanediamine N-(3-Aminopropyl)cadaverine N-3-Aminopropyl-1,5-diaminopentane C8H21N3 159.2724 159.173547687 (5-aminopentyl)(3-aminopropyl)amine aminopropylcadaverine 56-19-9 NCCCCCNCCCN InChI=1S/C8H21N3/c9-5-2-1-3-7-11-8-4-6-10/h11H,1-10H2 QZBYOYPROVGOGE-UHFFFAOYSA-N belongs to the class of organic compounds known as dialkylamines. These are organic compounds containing a dialkylamine group, characterized by two alkyl groups bonded to the amino nitrogen. Organic compounds Organic nitrogen compounds Organonitrogen compounds Amines Dialkylamines Hydrocarbon derivatives Monoalkylamines Organopnictogen compounds Aliphatic acyclic compound Hydrocarbon derivative Organopnictogen compound Primary aliphatic amine Primary amine Secondary aliphatic amine Aliphatic acyclic compounds polyazaalkane triamine Solid logp -0.09 ALOGPS logs -1.10 ALOGPS logp -0.7 ChemAxon pka_strongest_basic 10.9 ChemAxon iupac (5-aminopentyl)(3-aminopropyl)amine ChemAxon average_mass 159.2724 ChemAxon mono_mass 159.173547687 ChemAxon smiles NCCCCCNCCCN ChemAxon formula C8H21N3 ChemAxon inchi InChI=1S/C8H21N3/c9-5-2-1-3-7-11-8-4-6-10/h11H,1-10H2 ChemAxon inchikey QZBYOYPROVGOGE-UHFFFAOYSA-N ChemAxon polar_surface_area 64.07 ChemAxon refractivity 49.57 ChemAxon polarizability 20.9 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 3 ChemAxon donor_count 3 ChemAxon physiological_charge 3 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 12619 Specdb::CMs 152718 Specdb::MsIr 2694 Specdb::MsIr 2695 Specdb::MsIr 2696 Specdb::MsMs 24647 Specdb::MsMs 24648 Specdb::MsMs 24649 Specdb::MsMs 31205 Specdb::MsMs 31206 Specdb::MsMs 31207 Specdb::MsMs 2383139 Specdb::MsMs 2383140 Specdb::MsMs 2383141 Specdb::MsMs 2582465 Specdb::MsMs 2582466 Specdb::MsMs 2582467 Specdb::NmrOneD 151450 Specdb::NmrOneD 151451 Specdb::NmrOneD 151452 Specdb::NmrOneD 151453 Specdb::NmrOneD 151454 Specdb::NmrOneD 151455 Specdb::NmrOneD 151456 Specdb::NmrOneD 151457 Specdb::NmrOneD 151458 Specdb::NmrOneD 151459 Specdb::NmrOneD 151460 Specdb::NmrOneD 151461 Specdb::NmrOneD 151462 Specdb::NmrOneD 151463 Specdb::NmrOneD 151464 Specdb::NmrOneD 151465 Specdb::NmrOneD 151466 Specdb::NmrOneD 151467 Specdb::NmrOneD 151468 Specdb::NmrOneD 151469 C16565 FDB028841 58969 65523 64860 CPD0-1065