About 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one
4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one (PubChem CID 167702106) has the molecular formula C164H173ClF15N13O26
and a molecular weight of 3062.68 g/mol. Its IUPAC name is 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one.
Frequently Asked Questions
What is the IUPAC name of 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one?
The IUPAC name of 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one (CID 167702106) is 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one.
What is the SMILES notation for 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one?
The canonical SMILES for 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one is CCCOc1ccc(C(C)(O)CCC(=O)c2ccc(OC3CC3)c(OC)c2)nc1-c1ccc(F)cc1.COc1cc(C(=O)CCC(C)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OCCO.COc1cc(C(=O)CCC(C)(O)c2ccc(OCCN)c(-c3ccc(C)cc3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC1CC(F)C1.Cc1cc(-c2cc(C(C)(C)N)cc(C(O)(CCC(=O)c3cn4cccnc4n3)C(F)(F)F)n2)ccc1F.Cc1cc(-c2cc(C(C)(C)N)cc(C(O)(CCC(=O)c3coc(Cl)n3)C(F)(F)F)n2)ccc1F.
What is the InChIKey of 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one?
The InChIKey is YNVUYPOLUIEUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28F5NO5.C29H32FNO5.C29H34N2O5.C28H32FNO6.C26H25F4N5O2.C23H22ClF4N3O3/c1-16-12-18(4-6-21(16)31)27-24(38-2)8-9-26(35-27)28(37,29(32,33)34)11-10-22(36)17-5-7-23(25(13-17)39-3)40-20-14-19(30)15-20;1-4-17-35-25-13-14-27(31-28(25)19-5-8-21(30)9-6-19)29(2,33)16-15-23(32)20-7-12-24(26(18-20)34-3)36-22-10-11-22;1-19-4-6-20(7-5-19)28-25(35-17-16-30)12-13-27(31-28)29(2,33)15-14-23(32)21-8-11-24(26(18-21)34-3)36-22-9-10-22;1-18-15-20(5-7-21(18)29)27-24(34-3)9-10-26(30-27)28(2,17-32)12-11-22(33)19-6-8-23(36-14-13-31)25(16-19)35-4;1-15-11-16(5-6-18(15)27)19-12-17(24(2,3)31)13-22(33-19)25(37,26(28,29)30)8-7-21(36)20-14-35-10-4-9-32-23(35)34-20;1-12-8-13(4-5-15(12)25)16-9-14(21(2,3)29)10-19(30-16)22(33,23(26,27)28)7-6-18(32)17-11-34-20(24)31-17/h4-9,12-13,19-20,37H,10-11,14-15H2,1-3H3;5-9,12-14,18,22,33H,4,10-11,15-17H2,1-3H3;4-8,11-13,18,22,33H,9-10,14-17,30H2,1-3H3;5-10,15-16,31-32H,11-14,17H2,1-4H3;4-6,9-14,37H,7-8,31H2,1-3H3;4-5,8-11,33H,6-7,29H2,1-3H3.
What are the key properties of 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one?
4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one has a molecular weight of 3062.68 g/mol, XLogP of 32.20, 60 rotatable bonds, 10 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(2-aminoethoxy)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(2-chloro-1,3-oxazol-4-yl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-imidazo[1,2-a]pyrimidin-2-ylpentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluorophenyl)-5-propoxy-2-pyridinyl]-4-hydroxypentan-1-one;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-methylpentan-1-one;5,5,5-trifluoro-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one is sourced from PubChem (CID 167702106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).