1.0 2010-04-08 22:09:22 UTC 2018-05-28 22:25:28 UTC FDB010913 2-Amino-3,4,8-trimethyl-3H-imidazo[4,5-f]quinoxaline Pyrolysis production from creatine, threonine and glucose in cooked food. 2-Amino-3,4,8-trimethylimidazo(4,5-f)quinoxaline 2-Amino-3,4,8-trimethylimidazo[4,5-f ]quinoxaline 3,4,8-Trimethyl-3H-imidazo(4,5-f)quinoxalin-2-amine 3,4,8-Trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine, 9CI 3,4,8-Trimethylimidazo(4,5-f)quinoxalin-2-amine 3H-Imidazo(4,5-f)quinoxalin-2-amine, 3,4,8-trimethyl- 4,8-Di-MeIQx 4,8-Dimethyl IQX 4,8-Dimethyl-IQX Di-meiqx Dimethyl-iqx C12H13N5 227.2651 227.117095441 3,4,8-trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine 3,4,8-trimethylimidazo[4,5-f]quinoxalin-2-amine 95896-78-9 CN1C(N)=NC2=C1C(C)=CC1=C2N=C(C)C=N1 InChI=1S/C12H13N5/c1-6-4-8-9(15-7(2)5-14-8)10-11(6)17(3)12(13)16-10/h4-5H,1-3H3,(H2,13,16) LAZSIJHHPMHKQI-UHFFFAOYSA-N belongs to the class of organic compounds known as quinoxalines. Quinoxalines are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring. Quinoxalines Organic compounds Organoheterocyclic compounds Diazanaphthalenes Benzodiazines Aromatic heteropolycyclic compounds Aminoimidazoles Azacyclic compounds Benzenoids Benzimidazoles Heteroaromatic compounds Hydrocarbon derivatives N-substituted imidazoles Organopnictogen compounds Primary amines Pyrazines Amine Aminoimidazole Aromatic heteropolycyclic compound Azacycle Azole Benzenoid Benzimidazole Heteroaromatic compound Hydrocarbon derivative Imidazole N-substituted imidazole Organic nitrogen compound Organonitrogen compound Organopnictogen compound Primary amine Pyrazine Quinoxaline logp 1.35 ALOGPS logs -2.72 ALOGPS solubility 4.33e-01 g/l ALOGPS melting_point Mp 300° logp 1.31 ChemAxon pka_strongest_basic 5.14 ChemAxon iupac 3,4,8-trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine ChemAxon average_mass 227.2651 ChemAxon mono_mass 227.117095441 ChemAxon smiles CN1C(N)=NC2=C1C(C)=CC1=C2N=C(C)C=N1 ChemAxon formula C12H13N5 ChemAxon inchi InChI=1S/C12H13N5/c1-6-4-8-9(15-7(2)5-14-8)10-11(6)17(3)12(13)16-10/h4-5H,1-3H3,(H2,13,16) ChemAxon inchikey LAZSIJHHPMHKQI-UHFFFAOYSA-N ChemAxon polar_surface_area 69.62 ChemAxon refractivity 65.06 ChemAxon polarizability 25.02 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21775 Specdb::CMs 161228 Specdb::MsMs 48519 Specdb::MsMs 48520 Specdb::MsMs 48521 Specdb::MsMs 155352 Specdb::MsMs 155353 Specdb::MsMs 155354 Specdb::MsMs 2277207 Specdb::MsMs 2277208 Specdb::MsMs 2277209 Specdb::MsMs 3088267 Specdb::MsMs 3088268 Specdb::MsMs 3088269 HMDB32928 #<Reference:0x000055ac3fb44d08> #<Reference:0x000055ac3fb44b50> #<Reference:0x000055ac3fb44920> #<Reference:0x000055ac3fb44718> #<Reference:0x000055ac3fb44510> #<Reference:0x000055ac3fb44358> #<Reference:0x000055ac3fb441a0> #<Reference:0x000055ac3fb53f60> #<Reference:0x000055ac3fb53c90> #<Reference:0x000055ac3fb53a10>