5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea

C179H195F15N10O30 — CID 167662534

IUPAC5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea
SMILESCCNC(=O)NC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.CCNC(C)(C)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(F)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CN)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC1CC1
InChIInChI=1S/C33H37F4N3O5.C32H37F3N2O4.C30H31F4NO5.C28H29F2NO5.C28H31FN2O5.C28H30FNO6/c1-6-38-30(42)40-31(3,4)22-17-25(20-7-11-24(34)19(2)15-20)39-29(18-22)32(43,33(35,36)37)14-13-26(41)21-8-12-27(28(16-21)44-5)45-23-9-10-23;1-6-36-30(3,4)23-18-25(21-9-7-20(2)8-10-21)37-29(19-23)31(39,32(33,34)35)16-15-26(38)22-11-14-27(28(17-22)40-5)41-24-12-13-24;1-17-13-18(5-9-22(17)31)23-15-20(28(2,3)37)16-27(35-23)29(38,30(32,33)34)12-11-24(36)19-6-10-25(26(14-19)39-4)40-21-7-8-21;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(30,16-32)13-12-22(33)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(33,16-30)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(30-27)28(33,16-31)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20/h7-8,11-12,15-18,23,43H,6,9-10,13-14H2,1-5H3,(H2,38,40,42);7-11,14,17-19,24,36,39H,6,12-13,15-16H2,1-5H3;5-6,9-10,13-16,21,37-38H,7-8,11-12H2,1-4H3;4-5,8-11,14-15,20,32H,6-7,12-13,16H2,1-3H3;4-5,8-11,14-15,20,33H,6-7,12-13,16,30H2,1-3H3;4-5,8-11,14-15,20,31,33H,6-7,12-13,16H2,1-3H3
InChIKeySDQGQBQCSCULQJ-UHFFFAOYSA-N
MW3251.54 g/mol
LogP34.70
Rot. Bonds67

About 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea

5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea (PubChem CID 167662534) has the molecular formula C179H195F15N10O30 and a molecular weight of 3251.54 g/mol. Its IUPAC name is 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea.

Molecular Properties

Compound Name5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea
PubChem CID167662534
Molecular FormulaC179H195F15N10O30
Molecular Weight3251.54 g/mol
Exact Mass3249.38
IUPAC Name5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea
SMILESCCNC(=O)NC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.CCNC(C)(C)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(F)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CN)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC1CC1
InChIInChI=1S/C33H37F4N3O5.C32H37F3N2O4.C30H31F4NO5.C28H29F2NO5.C28H31FN2O5.C28H30FNO6/c1-6-38-30(42)40-31(3,4)22-17-25(20-7-11-24(34)19(2)15-20)39-29(18-22)32(43,33(35,36)37)14-13-26(41)21-8-12-27(28(16-21)44-5)45-23-9-10-23;1-6-36-30(3,4)23-18-25(21-9-7-20(2)8-10-21)37-29(19-23)31(39,32(33,34)35)16-15-26(38)22-11-14-27(28(17-22)40-5)41-24-12-13-24;1-17-13-18(5-9-22(17)31)23-15-20(28(2,3)37)16-27(35-23)29(38,30(32,33)34)12-11-24(36)19-6-10-25(26(14-19)39-4)40-21-7-8-21;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(30,16-32)13-12-22(33)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(33,16-30)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(30-27)28(33,16-31)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20/h7-8,11-12,15-18,23,43H,6,9-10,13-14H2,1-5H3,(H2,38,40,42);7-11,14,17-19,24,36,39H,6,12-13,15-16H2,1-5H3;5-6,9-10,13-16,21,37-38H,7-8,11-12H2,1-4H3;4-5,8-11,14-15,20,32H,6-7,12-13,16H2,1-3H3;4-5,8-11,14-15,20,33H,6-7,12-13,16,30H2,1-3H3;4-5,8-11,14-15,20,31,33H,6-7,12-13,16H2,1-3H3
InChIKeySDQGQBQCSCULQJ-UHFFFAOYSA-N
XLogP34.70
TPSA559.23 Ų
H-Bond Donors12
H-Bond Acceptors38
Rotatable Bonds67
Heavy Atoms234
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003251.54
LogP ≤ 534.70
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1038

Analyze 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea with MolForge

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Launch Full Analysis

Related Compounds

benzyl N-[2-[6-[3-[(4-cyclopropyloxy-3-methoxybenzoyl)amino]-1,1,1-trifluoro-2-hydroxypropan-2-yl]-2-(4-fluorophenyl)-3-methoxy-4-pyridinyl]propan-2-yl]carbamate
CID 117924845
N-[2-[4-amino-4-cyclopropyl-8-(4-fluorophenyl)-2,3-dihydropyrano[2,3-c]pyridin-6-yl]-3,3,3-trifluoro-2-hydroxypropyl]-4-(2-hydroxypropoxy)-3-methoxybenzamide
CID 122503185
N-[2-[4-amino-4-cyclopropyl-8-(4-fluorophenyl)-2,3-dihydropyrano[2,3-c]pyridin-6-yl]-3,3,3-trifluoro-2-hydroxypropyl]-4-[(2R)-2-hydroxypropoxy]-3-methoxybenzamide
CID 122503241
N-[[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluoro-3-methylphenyl)-4-pyridinyl]methyl]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]methanesulfonamide;N-[[2-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-methylphenyl)-4-pyridinyl]methyl]acetamide;ethyl 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]carbamate;4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[3-methoxy-4-(1H-pyrazol-5-ylmethoxy)phenyl]pentan-1-one
CID 157122856
2-[4-[4-[4-(2-Aminopropan-2-yl)-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetic acid;4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;4-[4-[2-(cyclobutylamino)propan-2-yl]-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-[2-(oxetan-3-ylamino)propan-2-yl]-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-piperidin-4-yl-2-pyridinyl]-4-hydroxypentan-1-one
CID 157131388
4-[4-(2-aminopropan-2-yl)-6-(4-fluorophenyl)-2-pyridinyl]-1-[3-cyclopropyloxy-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;tert-butyl N-[2-[2-(1-amino-2-hydroxypropan-2-yl)-6-(4-fluorophenyl)-4-pyridinyl]propan-2-yl]carbamate;tert-butyl N-[2-[2-[5-[3-cyclopropyloxy-4-(2-hydroxyethoxy)phenyl]-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-6-(4-fluorophenyl)-4-pyridinyl]propan-2-yl]carbamate;3-cyclopropyloxy-4-(2-hydroxyethoxy)benzoic acid
CID 157199239
4-[4-(1-amino-2-methylpropan-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-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxy-1-[4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl]pentan-1-one;benzyl N-[2-[2-(3-chloro-4-fluorophenyl)-6-[5-(4-cyclopropyloxy-3-methoxyphenyl)-1,1,1-trifluoro-2-hydroxy-5-oxopentan-2-yl]-4-pyridinyl]propan-2-yl]carbamate;2-[4-[4-cyclopropyl-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxybutanoyl]-2-methoxyphenoxy]acetamide;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(dimethylamino)propan-2-yl]-6-(4-fluoro-3-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]-N-methylacetamide
CID 157281477
4-[4-(2-aminopropan-2-yl)-6-(4-fluorophenyl)-5-methoxy-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-hydroxypentan-1-one;2-[2-[6-(3-amino-1,1,1-trifluoro-2-hydroxypropan-2-yl)-2-chloro-3-methoxy-4-pyridinyl]propan-2-ylamino]-1-phenylethanone;benzyl N-[2-[2-chloro-6-[5-(4-cyclopropyloxy-3-methoxyphenyl)-2-hydroxy-5-oxopentan-2-yl]-3-methoxy-4-pyridinyl]propan-2-yl]carbamate;benzyl N-[2-[6-[5-(4-cyclopropyloxy-3-methoxyphenyl)-2-hydroxy-5-oxopentan-2-yl]-2-(4-fluorophenyl)-3-methoxy-4-pyridinyl]propan-2-yl]carbamate;2-[2-[2-chloro-3-methoxy-6-(1,1,1-trifluoro-2-hydroxy-3-nitropropan-2-yl)-4-pyridinyl]propan-2-ylamino]-1-phenylethanone
CID 157288933
1-(4-Cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[8-(4-fluoro-3-methylphenyl)-4,4-dimethyl-2,3-dihydropyrano[2,3-c]pyridin-6-yl]-4-hydroxypentan-1-one;1-[4-(2,2-difluoroethoxy)-3-methoxyphenyl]-4-hydroxy-4-[5-methoxy-6-(4-methylphenyl)-2-pyridinyl]pentan-1-one;4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-1-[4-(2-hydroxypropoxy)-3-methoxyphenyl]pentan-1-one;2-[4-[4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]pentanoyl]-2-methoxyphenoxy]acetamide;3-[4-[4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]pentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;3-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]piperidin-2-one;5,5,5-trifluoro-4-[8-(4-fluoro-3-methylphenyl)-4,4-dimethyl-2,3-dihydropyrano[2,3-c]pyridin-6-yl]-4-hydroxy-1-[4-(2-hydroxypropoxy)-3-methoxyphenyl]pentan-1-one
CID 157297350
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
4-[3-amino-7-(4-methylphenyl)-3-propan-2-yl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]pentan-1-one;2-[4-[(4S)-4-[4-(2-aminopropan-2-yl)-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentanoyl]-2-methoxyphenoxy]acetamide;4-[4-(2-aminopropan-2-yl)-6-(6-methyl-3-pyridinyl)-2-pyridinyl]-1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(3-hydroxy-1-methylcyclobutyl)-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-methylazetidin-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one
CID 157411608
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

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea?
The IUPAC name of 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea (CID 167662534) is 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea.
What is the SMILES notation for 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea?
The canonical SMILES for 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea is CCNC(=O)NC(C)(C)c1cc(-c2ccc(F)c(C)c2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.CCNC(C)(C)c1cc(-c2ccc(C)cc2)nc(C(O)(CCC(=O)c2ccc(OC3CC3)c(OC)c2)C(F)(F)F)c1.COc1cc(C(=O)CCC(F)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CN)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(CO)c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)ccc1OC1CC1.COc1cc(C(=O)CCC(O)(c2cc(C(C)(C)O)cc(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC1CC1.
What is the InChIKey of 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea?
The InChIKey is SDQGQBQCSCULQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H37F4N3O5.C32H37F3N2O4.C30H31F4NO5.C28H29F2NO5.C28H31FN2O5.C28H30FNO6/c1-6-38-30(42)40-31(3,4)22-17-25(20-7-11-24(34)19(2)15-20)39-29(18-22)32(43,33(35,36)37)14-13-26(41)21-8-12-27(28(16-21)44-5)45-23-9-10-23;1-6-36-30(3,4)23-18-25(21-9-7-20(2)8-10-21)37-29(19-23)31(39,32(33,34)35)16-15-26(38)22-11-14-27(28(17-22)40-5)41-24-12-13-24;1-17-13-18(5-9-22(17)31)23-15-20(28(2,3)37)16-27(35-23)29(38,30(32,33)34)12-11-24(36)19-6-10-25(26(14-19)39-4)40-21-7-8-21;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(30,16-32)13-12-22(33)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(31-27)28(33,16-30)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20;1-17-14-19(4-8-21(17)29)27-24(34-2)10-11-26(30-27)28(33,16-31)13-12-22(32)18-5-9-23(25(15-18)35-3)36-20-6-7-20/h7-8,11-12,15-18,23,43H,6,9-10,13-14H2,1-5H3,(H2,38,40,42);7-11,14,17-19,24,36,39H,6,12-13,15-16H2,1-5H3;5-6,9-10,13-16,21,37-38H,7-8,11-12H2,1-4H3;4-5,8-11,14-15,20,32H,6-7,12-13,16H2,1-3H3;4-5,8-11,14-15,20,33H,6-7,12-13,16,30H2,1-3H3;4-5,8-11,14-15,20,31,33H,6-7,12-13,16H2,1-3H3.
What are the key properties of 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea?
5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea has a molecular weight of 3251.54 g/mol, XLogP of 34.70, 67 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[4-[2-(ethylamino)propan-2-yl]-6-(4-methylphenyl)-2-pyridinyl]-5,5,5-trifluoro-4-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-fluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-5-hydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4,5-dihydroxypentan-1-one;1-(4-cyclopropyloxy-3-methoxyphenyl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-4-(2-hydroxypropan-2-yl)-2-pyridinyl]-4-hydroxypentan-1-one;1-[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]-3-ethylurea is sourced from PubChem (CID 167662534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).