About 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one
4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one (PubChem CID 157476909) has the molecular formula C183H204F17N15O29
and a molecular weight of 3400.69 g/mol. Its IUPAC name is 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one.
Frequently Asked Questions
What is the IUPAC name of 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The IUPAC name of 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one (CID 157476909) is 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one.
What is the SMILES notation for 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The canonical SMILES for 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one is CNC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2cc(OC)c3ncccc3c2)C(F)(F)F)c1.CNC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(OCC(N)=O)c(OC)c2)C(F)(F)F)c1.CNC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(OC[C@@H](C)O)c(OC)c2)C(F)(F)F)c1.CNC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(O[C@H]3CCNC3=O)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(C)(O)c2cc(C(C)(N)CO)cc(-c3ccc(C)cc3)n2)ccc1OCCO.COc1cc(C(=O)CCC(C)(O)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)N)ccc1OC1CC1.
What is the InChIKey of 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The InChIKey is BVRVTIPKSDJIHJ-GVPJWYKISA-N. The full InChI is InChI=1S/C32H35F4N3O5.C31H31F4N3O3.C31H36F4N2O5.C30H33F4N3O5.C30H33FN2O5.C29H36N2O6/c1-18-14-19(6-8-22(18)33)23-16-21(30(2,3)37-4)17-28(39-23)31(42,32(34,35)36)12-10-24(40)20-7-9-25(27(15-20)43-5)44-26-11-13-38-29(26)41;1-18-13-19(8-9-23(18)32)24-16-22(29(2,3)36-4)17-27(38-24)30(40,31(33,34)35)11-10-25(39)21-14-20-7-6-12-37-28(20)26(15-21)41-5;1-18-13-20(7-9-23(18)32)24-15-22(29(3,4)36-5)16-28(37-24)30(40,31(33,34)35)12-11-25(39)21-8-10-26(27(14-21)41-6)42-17-19(2)38;1-17-12-18(6-8-21(17)31)22-14-20(28(2,3)36-4)15-26(37-22)29(40,30(32,33)34)11-10-23(38)19-7-9-24(25(13-19)41-5)42-16-27(35)39;1-17-13-19(5-9-22(17)31)27-28-21(29(2,32)16-37-28)15-26(33-27)30(3,35)12-11-23(34)18-6-10-24(25(14-18)36-4)38-20-7-8-20;1-19-5-7-20(8-6-19)23-16-22(28(2,30)18-33)17-27(31-23)29(3,35)12-11-24(34)21-9-10-25(37-14-13-32)26(15-21)36-4/h6-9,14-17,26,37,42H,10-13H2,1-5H3,(H,38,41);6-9,12-17,36,40H,10-11H2,1-5H3;7-10,13-16,19,36,38,40H,11-12,17H2,1-6H3;6-9,12-15,36,40H,10-11,16H2,1-5H3,(H2,35,39);5-6,9-10,13-15,20,35H,7-8,11-12,16,32H2,1-4H3;5-10,15-17,32-33,35H,11-14,18,30H2,1-4H3/t26-,31?;;19-,30?;;;/m0.1.../s1.
What are the key properties of 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one?
4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one has a molecular weight of 3400.69 g/mol, XLogP of 31.38, 65 rotatable bonds, 17 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-amino-7-(4-fluoro-3-methylphenyl)-3-methyl-2H-furo[2,3-c]pyridin-5-yl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;(3S)-3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(methylamino)propan-2-yl]-2-pyridinyl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one is sourced from PubChem (CID 157476909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).