1.0 2020-03-10 17:01:49 UTC 2020-04-22 18:56:18 UTC BMDB0096138 BMDB96138 Bufotenin 3-[2-(Dimethylamino)ethyl]-5-indolol 3-[2-(Dimethylamino)ethyl]indol-5-ol 3-[beta-(Dimethylamino)ethyl]-5-hydroxyindole 5-Hydroxy-N,N-dimethyltryptamine Bufotenine DM5-HT N,N-Dimethylserotonin 3-[b-(Dimethylamino)ethyl]-5-hydroxyindole 3-[Β-(dimethylamino)ethyl]-5-hydroxyindole 1H-indol-5-Ol, {3-[2-(dimethylamino)ethyl]-} 3-(2-(Dimethylamino)ethyl)-1H-indol-5-ol (acd/name 4.0) 3-(2-Dimethylaminoethyl)-5-indolol 3-(2-Dimethylaminoethyl)indol-5-ol 3-(beta-Dimethylaminoethyl)-5-hydroxyindole 3-[2-(Dimethylamino)ethyl]-1H-indol-5-ol 3-[2-(Dimethylamino)ethyl]-indol-5-ol 5-Hydroxy-N, N-dimethyltryptamine Cinobufotenine Cohoba Dimethylserotonin indol-5-Ol, {3-[2-(dimethylamino)ethyl]-} Mapine Mappin Mappine N, N-Dimethylserotonin N,N-Dimethyl-5-hydroxytryptamine {3-[(2-dimethylamino)ethyl]-5-indolol} {3-[(beta-dimethylamino)ethyl]-5-hydroxyindole} N,N Dimethyl 5 hydroxytryptamine 5 Hydroxy N,N dimethyltryptamine Bufotenin C12H16N2O 204.2682 204.126263144 3-[2-(dimethylamino)ethyl]-1H-indol-5-ol bufotenine 487-93-4 CN(C)CCC1=CNC2=C1C=C(O)C=C2 InChI=1S/C12H16N2O/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12/h3-4,7-8,13,15H,5-6H2,1-2H3 VTTONGPRPXSUTJ-UHFFFAOYSA-N belongs to the class of organic compounds known as serotonins. Serotonins are compounds containing a serotonin moiety, which consists of an indole that bears an aminoethyl a position 2 and a hydroxyl group at position 5. Organic compounds Organoheterocyclic compounds Indoles and derivatives Tryptamines and derivatives Serotonins 1-hydroxy-2-unsubstituted benzenoids 3-alkylindoles Alkaloids and derivatives Aralkylamines Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Hydroxyindoles Organooxygen compounds Organopnictogen compounds Substituted pyrroles Trialkylamines 1-hydroxy-2-unsubstituted benzenoid 3-alkylindole Alkaloid or derivatives Amine Aralkylamine Aromatic heteropolycyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Hydroxyindole Indole Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Pyrrole Serotonin Substituted pyrrole Tertiary aliphatic amine Tertiary amine Aromatic heteropolycyclic compounds Indole alkaloids tertiary amine tryptamine alkaloid logp 2.04 ALOGPS logs -1.81 ALOGPS logp 1.29 ChemAxon pka_strongest_acidic 9.23 ChemAxon pka_strongest_basic 9.91 ChemAxon iupac 3-[2-(dimethylamino)ethyl]-1H-indol-5-ol ChemAxon average_mass 204.2682 ChemAxon mono_mass 204.126263144 ChemAxon smiles CN(C)CCC1=CNC2=C1C=C(O)C=C2 ChemAxon formula C12H16N2O ChemAxon inchi InChI=1S/C12H16N2O/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12/h3-4,7-8,13,15H,5-6H2,1-2H3 ChemAxon inchikey VTTONGPRPXSUTJ-UHFFFAOYSA-N ChemAxon polar_surface_area 39.26 ChemAxon refractivity 62.42 ChemAxon polarizability 23.29 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsIr 9416 Specdb::MsIr 9417 Specdb::MsIr 9418 Specdb::CMs 19962 Specdb::CMs 47584 Specdb::CMs 135474 Specdb::CMs 143208 Specdb::EiMs 179 Specdb::NmrOneD 50162 Specdb::NmrOneD 50163 Specdb::NmrOneD 50164 Specdb::NmrOneD 50165 Specdb::NmrOneD 50166 Specdb::NmrOneD 50167 Specdb::NmrOneD 50168 Specdb::NmrOneD 50169 Specdb::NmrOneD 50170 Specdb::NmrOneD 50171 Specdb::NmrOneD 50172 Specdb::NmrOneD 50173 Specdb::NmrOneD 50174 Specdb::NmrOneD 50175 Specdb::NmrOneD 50176 Specdb::NmrOneD 50177 Specdb::NmrOneD 50178 Specdb::NmrOneD 50179 Specdb::NmrOneD 50180 Specdb::NmrOneD 50181 Specdb::MsMs 68796 Specdb::MsMs 68797 Specdb::MsMs 68798 Specdb::MsMs 126909 Specdb::MsMs 126910 Specdb::MsMs 126911 Specdb::MsMs 2421429 Specdb::MsMs 2421430 Specdb::MsMs 2421431 Specdb::MsMs 2545012 Specdb::MsMs 2545013 Specdb::MsMs 2545014 9839 DB01445 FDB111673 10257 C00001402 C08299 3210 Bufotenin