About 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone
1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone (PubChem CID 161226525) has the molecular formula C191H226F3N33O9S9
and a molecular weight of 3473.73 g/mol. Its IUPAC name is 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone.
Frequently Asked Questions
What is the IUPAC name of 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone?
The IUPAC name of 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone (CID 161226525) is 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone.
What is the SMILES notation for 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone?
The canonical SMILES for 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone is C=S(C)(=O)N1CCC(C(=O)Cc2cc3cc(-c4nnc(C)s4)ccc3cn2)CC1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(C5CCC5)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(C5CCCCC5)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(C5CCN(C)CC5)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(CC(C)(C)C)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(CC(C)(C)C)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(CC5(C(F)(F)F)CC5)CC4)cc3c2)s1.Cc1nnc(-c2ccc3cnc(CC(=O)C4CCN(CC5(C)CCC5)CC4)cc3c2)s1.
What is the InChIKey of 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone?
The InChIKey is UYEUWJYUJCJYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N5OS.2C25H30N4OS.C24H25F3N4OS.2C24H30N4OS.C23H26N4OS.C21H24N4O2S2/c1-17-27-28-25(32-17)19-3-4-20-16-26-22(14-21(20)13-19)15-24(31)18-5-11-30(12-6-18)23-7-9-29(2)10-8-23;1-17-27-28-24(31-17)19-4-5-20-15-26-22(13-21(20)12-19)14-23(30)18-6-10-29(11-7-18)16-25(2)8-3-9-25;1-17-27-28-25(31-17)19-7-8-20-16-26-22(14-21(20)13-19)15-24(30)18-9-11-29(12-10-18)23-5-3-2-4-6-23;1-15-29-30-22(33-15)17-2-3-18-13-28-20(11-19(18)10-17)12-21(32)16-4-8-31(9-5-16)14-23(6-7-23)24(25,26)27;2*1-16-26-27-23(30-16)18-5-6-19-14-25-21(12-20(19)11-18)13-22(29)17-7-9-28(10-8-17)15-24(2,3)4;1-15-25-26-23(29-15)17-5-6-18-14-24-20(12-19(18)11-17)13-22(28)16-7-9-27(10-8-16)21-3-2-4-21;1-14-23-24-21(28-14)16-4-5-17-13-22-19(11-18(17)10-16)12-20(26)15-6-8-25(9-7-15)29(2,3)27/h3-4,13-14,16,18,23H,5-12,15H2,1-2H3;4-5,12-13,15,18H,3,6-11,14,16H2,1-2H3;7-8,13-14,16,18,23H,2-6,9-12,15H2,1H3;2-3,10-11,13,16H,4-9,12,14H2,1H3;2*5-6,11-12,14,17H,7-10,13,15H2,1-4H3;5-6,11-12,14,16,21H,2-4,7-10,13H2,1H3;4-5,10-11,13,15H,2,6-9,12H2,1,3H3.
What are the key properties of 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone?
1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone has a molecular weight of 3473.73 g/mol, XLogP of 36.95, 42 rotatable bonds, 0 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclobutylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-(1-cyclohexylpiperidin-4-yl)-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;bis(1-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone);1-[1-[(1-methylcyclobutyl)methyl]piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(methyl-methylidene-oxo-λ6-sulfanyl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;1-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]ethanone;2-[6-(5-methyl-1,3,4-thiadiazol-2-yl)isoquinolin-3-yl]-1-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]piperidin-4-yl]ethanone is sourced from PubChem (CID 161226525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).