2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one

C180H197F20N13O36S — CID 160658315

IUPAC2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one
SMILESCOC(=O)C(C)(N)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)N)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OCC(=O)NS(C)(=O)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCC(N)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC[C@@H](C)O.COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO.COc1cc(C(=O)CC[C@@](O)(c2cc(C(C)(C)N)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO
InChIInChI=1S/C32H36F4N2O6.C31H34F3N3O6.C31H33F3N2O6.C30H33F4N3O7S.C29H33F3N2O5.C27H28F3NO6/c1-18-13-21(7-9-24(18)33)25-15-23(30(4,5)38-20(3)40)16-29(37-25)31(42,32(34,35)36)12-11-26(41)22-8-10-27(28(14-22)43-6)44-17-19(2)39;1-18-6-8-20(9-7-18)23-15-22(29(3,4)37-19(2)38)16-27(36-23)30(41,31(32,33)34)13-12-24(39)21-10-11-25(26(14-21)42-5)43-17-28(35)40;1-18-5-7-19(8-6-18)23-16-21(29(2,35)28(38)41-4)17-27(36-23)30(39,31(32,33)34)14-13-24(37)20-9-12-25(26(15-20)40-3)42-22-10-11-22;1-17-12-18(6-8-21(17)31)22-14-20(28(2,3)35)15-26(36-22)29(40,30(32,33)34)11-10-23(38)19-7-9-24(25(13-19)43-4)44-16-27(39)37-45(5,41)42;1-18-5-7-19(8-6-18)22-16-21(27(2,3)33)17-26(34-22)28(37,29(30,31)32)12-11-23(36)20-9-10-24(39-14-13-35)25(15-20)38-4;1-17-4-6-18(7-5-17)25-22(35-2)10-11-24(31-25)26(34,27(28,29)30)13-12-20(33)19-8-9-21(37-15-14-32)23(16-19)36-3/h7-10,13-16,19,39,42H,11-12,17H2,1-6H3,(H,38,40);6-11,14-16,41H,12-13,17H2,1-5H3,(H2,35,40)(H,37,38);5-9,12,15-17,22,39H,10-11,13-14,35H2,1-4H3;6-9,12-15,40H,10-11,16,35H2,1-5H3,(H,37,39);5-10,15-17,35,37H,11-14,33H2,1-4H3;4-11,16,32,34H,12-15H2,1-3H3/t19-,31?;;;;28-;/m1...1./s1
InChIKeyRLILRVCDHCGEGR-HJDFJUOZSA-N
MW3530.64 g/mol
LogP30.00
Rot. Bonds69

About 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one

2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one (PubChem CID 160658315) has the molecular formula C180H197F20N13O36S and a molecular weight of 3530.64 g/mol. Its IUPAC name is 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one.

Molecular Properties

Compound Name2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one
PubChem CID160658315
Molecular FormulaC180H197F20N13O36S
Molecular Weight3530.64 g/mol
Exact Mass3528.34
IUPAC Name2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one
SMILESCOC(=O)C(C)(N)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)N)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OCC(=O)NS(C)(=O)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCC(N)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC[C@@H](C)O.COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO.COc1cc(C(=O)CC[C@@](O)(c2cc(C(C)(C)N)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO
InChIInChI=1S/C32H36F4N2O6.C31H34F3N3O6.C31H33F3N2O6.C30H33F4N3O7S.C29H33F3N2O5.C27H28F3NO6/c1-18-13-21(7-9-24(18)33)25-15-23(30(4,5)38-20(3)40)16-29(37-25)31(42,32(34,35)36)12-11-26(41)22-8-10-27(28(14-22)43-6)44-17-19(2)39;1-18-6-8-20(9-7-18)23-15-22(29(3,4)37-19(2)38)16-27(36-23)30(41,31(32,33)34)13-12-24(39)21-10-11-25(26(14-21)42-5)43-17-28(35)40;1-18-5-7-19(8-6-18)23-16-21(29(2,35)28(38)41-4)17-27(36-23)30(39,31(32,33)34)14-13-24(37)20-9-12-25(26(15-20)40-3)42-22-10-11-22;1-17-12-18(6-8-21(17)31)22-14-20(28(2,3)35)15-26(36-22)29(40,30(32,33)34)11-10-23(38)19-7-9-24(25(13-19)43-4)44-16-27(39)37-45(5,41)42;1-18-5-7-19(8-6-18)22-16-21(27(2,3)33)17-26(34-22)28(37,29(30,31)32)12-11-23(36)20-9-10-24(39-14-13-35)25(15-20)38-4;1-17-4-6-18(7-5-17)25-22(35-2)10-11-24(31-25)26(34,27(28,29)30)13-12-20(33)19-8-9-21(37-15-14-32)23(16-19)36-3/h7-10,13-16,19,39,42H,11-12,17H2,1-6H3,(H,38,40);6-11,14-16,41H,12-13,17H2,1-5H3,(H2,35,40)(H,37,38);5-9,12,15-17,22,39H,10-11,13-14,35H2,1-4H3;6-9,12-15,40H,10-11,16,35H2,1-5H3,(H,37,39);5-10,15-17,35,37H,11-14,33H2,1-4H3;4-11,16,32,34H,12-15H2,1-3H3/t19-,31?;;;;28-;/m1...1./s1
InChIKeyRLILRVCDHCGEGR-HJDFJUOZSA-N
XLogP30.00
TPSA750.71 Ų
H-Bond Donors16
H-Bond Acceptors45
Rotatable Bonds69
Heavy Atoms250
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003530.64
LogP ≤ 530.00
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1045

Analyze 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-tert-butyl-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one;N'-[2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluoro-3-methylphenyl)-4-pyridinyl]propan-2-yl]ethanimidamide;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(propan-2-ylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]acetamide;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[6-(4-methylphenyl)-4-(1-propan-2-ylazetidin-3-yl)-2-pyridinyl]pentan-1-one
CID 167704539
4-[4-(aminomethyl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-[4-(2,2-difluorocyclopropyl)oxy-3-methoxyphenyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(4-ethoxy-3-methoxyphenyl)-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-1-[4-(3-fluorocyclobutyl)oxy-3-methoxyphenyl]-4-hydroxypentan-1-one;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;N-[2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluoro-3-methylphenyl)-4-pyridinyl]propan-2-yl]acetamide
CID 157400253
N-[2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluoro-3-methylphenyl)-4-pyridinyl]propan-2-yl]methanesulfonamide
CID 157122860
4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one
CID 159129597
2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-(2-methyl-1H-imidazol-5-yl)pentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-(2-methyl-1,3-oxazol-4-yl)pentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-(2-methyl-1,3-oxazol-5-yl)pentan-1-one;5-[4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-3H-1,3-benzoxazol-2-one;N-[2-[2-(4-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide
CID 167609197
N'-[2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluoro-3-methylphenyl)-4-pyridinyl]propan-2-yl]ethanimidamide
CID 159264625
4-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-5-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]pentan-1-one;4-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]pentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(7-methyl-1H-indol-3-yl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one;4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one
CID 160938242
(3R)-3-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one
CID 159833274
4-[4-(2-amino-1-hydroxypropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one
CID 159996318
4-[4-(2-amino-1-fluoropropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one
CID 159996317
N-[2-[2-(4-fluorophenyl)-6-[2-hydroxy-5-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide
CID 153153634
(4R)-4-[4-(2-aminopropan-2-yl)-6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-4-hydroxy-1-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]pentan-1-one
CID 159834871

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one?
The IUPAC name of 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one (CID 160658315) is 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one.
What is the SMILES notation for 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one?
The canonical SMILES for 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one is COC(=O)C(C)(N)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)N)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OCC(=O)NS(C)(=O)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCC(N)=O.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)NC(C)=O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC[C@@H](C)O.COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO.COc1cc(C(=O)CC[C@@](O)(c2cc(C(C)(C)N)cc(-c3ccc(C)cc3)n2)C(F)(F)F)ccc1OCCO.
What is the InChIKey of 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one?
The InChIKey is RLILRVCDHCGEGR-HJDFJUOZSA-N. The full InChI is InChI=1S/C32H36F4N2O6.C31H34F3N3O6.C31H33F3N2O6.C30H33F4N3O7S.C29H33F3N2O5.C27H28F3NO6/c1-18-13-21(7-9-24(18)33)25-15-23(30(4,5)38-20(3)40)16-29(37-25)31(42,32(34,35)36)12-11-26(41)22-8-10-27(28(14-22)43-6)44-17-19(2)39;1-18-6-8-20(9-7-18)23-15-22(29(3,4)37-19(2)38)16-27(36-23)30(41,31(32,33)34)13-12-24(39)21-10-11-25(26(14-21)42-5)43-17-28(35)40;1-18-5-7-19(8-6-18)23-16-21(29(2,35)28(38)41-4)17-27(36-23)30(39,31(32,33)34)14-13-24(37)20-9-12-25(26(15-20)40-3)42-22-10-11-22;1-17-12-18(6-8-21(17)31)22-14-20(28(2,3)35)15-26(36-22)29(40,30(32,33)34)11-10-23(38)19-7-9-24(25(13-19)43-4)44-16-27(39)37-45(5,41)42;1-18-5-7-19(8-6-18)22-16-21(27(2,3)33)17-26(34-22)28(37,29(30,31)32)12-11-23(36)20-9-10-24(39-14-13-35)25(15-20)38-4;1-17-4-6-18(7-5-17)25-22(35-2)10-11-24(31-25)26(34,27(28,29)30)13-12-20(33)19-8-9-21(37-15-14-32)23(16-19)36-3/h7-10,13-16,19,39,42H,11-12,17H2,1-6H3,(H,38,40);6-11,14-16,41H,12-13,17H2,1-5H3,(H2,35,40)(H,37,38);5-9,12,15-17,22,39H,10-11,13-14,35H2,1-4H3;6-9,12-15,40H,10-11,16,35H2,1-5H3,(H,37,39);5-10,15-17,35,37H,11-14,33H2,1-4H3;4-11,16,32,34H,12-15H2,1-3H3/t19-,31?;;;;28-;/m1...1./s1.
What are the key properties of 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one?
2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one has a molecular weight of 3530.64 g/mol, XLogP of 30.00, 69 rotatable bonds, 16 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[4-(2-acetamidopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;2-[4-[4-[4-(2-aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]-N-methylsulfonylacetamide;(4R)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;N-[2-[2-(4-fluoro-3-methylphenyl)-6-[1,1,1-trifluoro-2-hydroxy-5-[4-[(2R)-2-hydroxypropoxy]-3-methoxyphenyl]-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]acetamide;methyl 2-amino-2-[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]propanoate;5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one is sourced from PubChem (CID 160658315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).