About 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline
1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline (PubChem CID 159919218) has the molecular formula C199H282F3N35O7
and a molecular weight of 3333.68 g/mol. Its IUPAC name is 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline.
Frequently Asked Questions
What is the IUPAC name of 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline (CID 159919218) is 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline is C#Cc1cccnc1C(C)C.CC(C)c1nccn1C.CC1CCC2(CC2)n2ccnc21.CC1CCCn2ccnc21.CCc1ncc[nH]1.CCc1nccn1C.CCc1nccn1C1CC1.COc1cnc2c(c1)CCC[C@@H]2C.COc1cnc2c(c1)CCC[C@@H]2C.C[C@H]1CCC2(CC2)c2cccnc21.C[C@H]1CCCCn2ccnc21.C[C@H]1CCCCn2ccnc21.C[C@H]1CCCc2cc(OC(F)(F)F)cnc21.C[C@H]1CCCn2ccnc21.C[C@H]1COCC2(CC2)n2ccnc21.C[C@H]1COCC2(CC2)n2ccnc21.C[C@H]1COCCn2ccnc21.C[C@H]1COCCn2ccnc21.Cc1ccc(C(C)C)nc1.Cc1cccnc1C(C)C.Cc1ccnc(C(C)C)c1.Cc1cnc2c(c1)CCC[C@@H]2C.
What is the InChIKey of 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline?
The InChIKey is NYEJBXUAKHZIRS-PWVFCHSVSA-N. The full InChI is InChI=1S/C12H15N.C11H12F3NO.2C11H15NO.C11H15N.2C10H14N2O.C10H14N2.C10H11N.2C9H14N2.3C9H13N.2C8H12N2O.3C8H12N2.C7H12N2.C6H10N2.C5H8N2/c1-9-4-5-12(6-7-12)10-3-2-8-13-11(9)10;1-7-3-2-4-8-5-9(6-15-10(7)8)16-11(12,13)14;2*1-8-4-3-5-9-6-10(13-2)7-12-11(8)9;1-8-6-10-5-3-4-9(2)11(10)12-7-8;2*1-8-6-13-7-10(2-3-10)12-5-4-11-9(8)12;1-8-2-3-10(4-5-10)12-7-6-11-9(8)12;1-4-9-6-5-7-11-10(9)8(2)3;2*1-8-4-2-3-6-11-7-5-10-9(8)11;1-7(2)9-6-8(3)4-5-10-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;2*1-7-6-11-5-4-10-3-2-9-8(7)10;2*1-7-3-2-5-10-6-4-9-8(7)10;1-2-8-9-5-6-10(8)7-3-4-7;1-6(2)7-8-4-5-9(7)3;1-3-6-7-4-5-8(6)2;1-2-5-6-3-4-7-5/h2-3,8-9H,4-7H2,1H3;5-7H,2-4H2,1H3;2*6-8H,3-5H2,1-2H3;6-7,9H,3-5H2,1-2H3;2*4-5,8H,2-3,6-7H2,1H3;6-8H,2-5H2,1H3;1,5-8H,2-3H3;2*5,7-8H,2-4,6H2,1H3;3*4-7H,1-3H3;2*2-3,7H,4-6H2,1H3;2*4,6-7H,2-3,5H2,1H3;5-7H,2-4H2,1H3;4-6H,1-3H3;4-5H,3H2,1-2H3;3-4H,2H2,1H3,(H,6,7)/t9-;7-;2*8-;9-;2*8-;;;2*8-;;;;3*7-;;;;;/m0000000..00...000...../s1.
What are the key properties of 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline?
1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline has a molecular weight of 3333.68 g/mol, XLogP of 44.54, 12 rotatable bonds, 1 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-ethylimidazole;(8S)-3,8-dimethyl-5,6,7,8-tetrahydroquinoline;2-ethyl-1H-imidazole;2-ethyl-1-methylimidazole;3-ethynyl-2-propan-2-ylpyridine;bis((8S)-3-methoxy-8-methyl-5,6,7,8-tetrahydroquinoline);1-methyl-2-propan-2-ylimidazole;3-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;8-methylspiro[7,8-dihydro-6H-imidazo[1,2-a]pyridine-5,1'-cyclopropane];bis((9R)-9-methylspiro[8,9-dihydro-6H-imidazo[1,2-d][1,4]oxazepine-5,1'-cyclopropane]);(8S)-8-methylspiro[7,8-dihydro-6H-quinoline-5,1'-cyclopropane];bis((9S)-9-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine);8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;bis((9R)-9-methyl-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]oxazepine);(8S)-8-methyl-3-(trifluoromethoxy)-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 159919218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).