N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid

C284H288F15N67O54 — CID 157058825

IUPACN-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid
SMILESCC(C)NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCN(CC)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CN(C)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(C(=O)C5CC(F)(F)C5)nc4)C3=O)cn2)C1.CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.O=C(C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1)N1CCC(O)CC1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1
InChIInChI=1S/C28H29FN6O5.C27H29FN6O4.C26H27FN6O4.C25H24FN7O5.C25H25FN6O4.C24H26F2N6O4.C24H23FN6O4.C23H21FN6O4.C22H24N4O5.C21H23N5O5.C20H19F3N4O5.C19H18F3N5O5/c29-19-1-3-22(4-2-19)40-25-6-5-23(15-30-25)39-24-9-12-35(27(24)38)20-13-31-28(32-14-20)34-16-18(17-34)26(37)33-10-7-21(36)8-11-33;1-3-32(4-2)25(35)18-16-33(17-18)27-30-13-20(14-31-27)34-12-11-23(26(34)36)37-22-9-10-24(29-15-22)38-21-7-5-19(28)6-8-21;1-16(2)31-24(34)17-14-32(15-17)26-29-11-19(12-30-26)33-10-9-22(25(33)35)36-21-7-8-23(28-13-21)37-20-5-3-18(27)4-6-20;26-16-1-3-18(4-2-16)38-22-6-5-19(11-28-22)37-20-7-8-33(24(20)36)17-9-30-25(31-10-17)32-13-15(14-32)23(35)29-12-21(27)34;1-2-27-23(33)16-14-31(15-16)25-29-11-18(12-30-25)32-10-9-21(24(32)34)35-20-7-8-22(28-13-20)36-19-5-3-17(26)4-6-19;1-30(2)21(34)15-12-31(13-15)23-28-9-16(10-29-23)32-6-5-19(22(32)35)36-17-3-4-18(27-11-17)20(33)14-7-24(25,26)8-14;1-26-22(32)15-13-30(14-15)24-28-10-17(11-29-24)31-9-8-20(23(31)33)34-19-6-7-21(27-12-19)35-18-4-2-16(25)3-5-18;24-15-1-3-17(4-2-15)34-20-6-5-18(11-26-20)33-19-7-8-30(22(19)32)16-9-27-23(28-10-16)29-12-14(13-29)21(25)31;27-21-18(31-17-4-6-20(24-10-17)30-13-14-1-2-14)7-8-26(21)16-3-5-19(23-9-16)25-11-15(12-25)22(28)29;27-19-17(31-16-3-4-18(22-9-16)30-12-13-1-2-13)5-6-26(19)15-7-23-21(24-8-15)25-10-14(11-25)20(28)29;21-20(22,23)11-31-17-4-2-14(8-25-17)32-15-5-6-27(18(15)28)13-1-3-16(24-7-13)26-9-12(10-26)19(29)30;20-19(21,22)10-31-15-2-1-13(7-23-15)32-14-3-4-27(16(14)28)12-5-24-18(25-6-12)26-8-11(9-26)17(29)30/h1-6,13-15,18,21,24,36H,7-12,16-17H2;5-10,13-15,18,23H,3-4,11-12,16-17H2,1-2H3;3-8,11-13,16-17,22H,9-10,14-15H2,1-2H3,(H,31,34);1-6,9-11,15,20H,7-8,12-14H2,(H2,27,34)(H,29,35);3-8,11-13,16,21H,2,9-10,14-15H2,1H3,(H,27,33);3-4,9-11,14-15,19H,5-8,12-13H2,1-2H3;2-7,10-12,15,20H,8-9,13-14H2,1H3,(H,26,32);1-6,9-11,14,19H,7-8,12-13H2,(H2,25,31);3-6,9-10,14-15,18H,1-2,7-8,11-13H2,(H,28,29);3-4,7-9,13-14,17H,1-2,5-6,10-12H2,(H,28,29);1-4,7-8,12,15H,5-6,9-11H2,(H,29,30);1-2,5-7,11,14H,3-4,8-10H2,(H,29,30)/t24-;23-;22-;20-;21-;19-;20-;19-;18-;17-;15-;14-/m111111111111/s1
InChIKeyABBQRXMRTBGGGV-DQSRYYRISA-N
MW5788.81 g/mol
LogP25.09
Rot. Bonds92

About N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid

N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid (PubChem CID 157058825) has the molecular formula C284H288F15N67O54 and a molecular weight of 5788.81 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid
PubChem CID157058825
Molecular FormulaC284H288F15N67O54
Molecular Weight5788.81 g/mol
Exact Mass5785.16
IUPAC NameN-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid
SMILESCC(C)NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCN(CC)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CN(C)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(C(=O)C5CC(F)(F)C5)nc4)C3=O)cn2)C1.CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.O=C(C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1)N1CCC(O)CC1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1
InChIInChI=1S/C28H29FN6O5.C27H29FN6O4.C26H27FN6O4.C25H24FN7O5.C25H25FN6O4.C24H26F2N6O4.C24H23FN6O4.C23H21FN6O4.C22H24N4O5.C21H23N5O5.C20H19F3N4O5.C19H18F3N5O5/c29-19-1-3-22(4-2-19)40-25-6-5-23(15-30-25)39-24-9-12-35(27(24)38)20-13-31-28(32-14-20)34-16-18(17-34)26(37)33-10-7-21(36)8-11-33;1-3-32(4-2)25(35)18-16-33(17-18)27-30-13-20(14-31-27)34-12-11-23(26(34)36)37-22-9-10-24(29-15-22)38-21-7-5-19(28)6-8-21;1-16(2)31-24(34)17-14-32(15-17)26-29-11-19(12-30-26)33-10-9-22(25(33)35)36-21-7-8-23(28-13-21)37-20-5-3-18(27)4-6-20;26-16-1-3-18(4-2-16)38-22-6-5-19(11-28-22)37-20-7-8-33(24(20)36)17-9-30-25(31-10-17)32-13-15(14-32)23(35)29-12-21(27)34;1-2-27-23(33)16-14-31(15-16)25-29-11-18(12-30-25)32-10-9-21(24(32)34)35-20-7-8-22(28-13-20)36-19-5-3-17(26)4-6-19;1-30(2)21(34)15-12-31(13-15)23-28-9-16(10-29-23)32-6-5-19(22(32)35)36-17-3-4-18(27-11-17)20(33)14-7-24(25,26)8-14;1-26-22(32)15-13-30(14-15)24-28-10-17(11-29-24)31-9-8-20(23(31)33)34-19-6-7-21(27-12-19)35-18-4-2-16(25)3-5-18;24-15-1-3-17(4-2-15)34-20-6-5-18(11-26-20)33-19-7-8-30(22(19)32)16-9-27-23(28-10-16)29-12-14(13-29)21(25)31;27-21-18(31-17-4-6-20(24-10-17)30-13-14-1-2-14)7-8-26(21)16-3-5-19(23-9-16)25-11-15(12-25)22(28)29;27-19-17(31-16-3-4-18(22-9-16)30-12-13-1-2-13)5-6-26(19)15-7-23-21(24-8-15)25-10-14(11-25)20(28)29;21-20(22,23)11-31-17-4-2-14(8-25-17)32-15-5-6-27(18(15)28)13-1-3-16(24-7-13)26-9-12(10-26)19(29)30;20-19(21,22)10-31-15-2-1-13(7-23-15)32-14-3-4-27(16(14)28)12-5-24-18(25-6-12)26-8-11(9-26)17(29)30/h1-6,13-15,18,21,24,36H,7-12,16-17H2;5-10,13-15,18,23H,3-4,11-12,16-17H2,1-2H3;3-8,11-13,16-17,22H,9-10,14-15H2,1-2H3,(H,31,34);1-6,9-11,15,20H,7-8,12-14H2,(H2,27,34)(H,29,35);3-8,11-13,16,21H,2,9-10,14-15H2,1H3,(H,27,33);3-4,9-11,14-15,19H,5-8,12-13H2,1-2H3;2-7,10-12,15,20H,8-9,13-14H2,1H3,(H,26,32);1-6,9-11,14,19H,7-8,12-13H2,(H2,25,31);3-6,9-10,14-15,18H,1-2,7-8,11-13H2,(H,28,29);3-4,7-9,13-14,17H,1-2,5-6,10-12H2,(H,28,29);1-4,7-8,12,15H,5-6,9-11H2,(H,29,30);1-2,5-7,11,14H,3-4,8-10H2,(H,29,30)/t24-;23-;22-;20-;21-;19-;20-;19-;18-;17-;15-;14-/m111111111111/s1
InChIKeyABBQRXMRTBGGGV-DQSRYYRISA-N
XLogP25.09
TPSA1383.16 Ų
H-Bond Donors11
H-Bond Acceptors96
Rotatable Bonds92
Heavy Atoms420
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005788.81
LogP ≤ 525.09
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1096

Analyze N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid?
The IUPAC name of N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid (CID 157058825) is N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid?
The canonical SMILES for N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid is CC(C)NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCN(CC)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CCNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.CN(C)C(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(C(=O)C5CC(F)(F)C5)nc4)C3=O)cn2)C1.CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.NC(=O)CNC(=O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1.O=C(C1CN(c2ncc(N3CC[C@@H](Oc4ccc(Oc5ccc(F)cc5)nc4)C3=O)cn2)C1)N1CCC(O)CC1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ccc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC(F)(F)F)nc4)C3=O)cn2)C1.O=C(O)C1CN(c2ncc(N3CC[C@@H](Oc4ccc(OCC5CC5)nc4)C3=O)cn2)C1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid?
The InChIKey is ABBQRXMRTBGGGV-DQSRYYRISA-N. The full InChI is InChI=1S/C28H29FN6O5.C27H29FN6O4.C26H27FN6O4.C25H24FN7O5.C25H25FN6O4.C24H26F2N6O4.C24H23FN6O4.C23H21FN6O4.C22H24N4O5.C21H23N5O5.C20H19F3N4O5.C19H18F3N5O5/c29-19-1-3-22(4-2-19)40-25-6-5-23(15-30-25)39-24-9-12-35(27(24)38)20-13-31-28(32-14-20)34-16-18(17-34)26(37)33-10-7-21(36)8-11-33;1-3-32(4-2)25(35)18-16-33(17-18)27-30-13-20(14-31-27)34-12-11-23(26(34)36)37-22-9-10-24(29-15-22)38-21-7-5-19(28)6-8-21;1-16(2)31-24(34)17-14-32(15-17)26-29-11-19(12-30-26)33-10-9-22(25(33)35)36-21-7-8-23(28-13-21)37-20-5-3-18(27)4-6-20;26-16-1-3-18(4-2-16)38-22-6-5-19(11-28-22)37-20-7-8-33(24(20)36)17-9-30-25(31-10-17)32-13-15(14-32)23(35)29-12-21(27)34;1-2-27-23(33)16-14-31(15-16)25-29-11-18(12-30-25)32-10-9-21(24(32)34)35-20-7-8-22(28-13-20)36-19-5-3-17(26)4-6-19;1-30(2)21(34)15-12-31(13-15)23-28-9-16(10-29-23)32-6-5-19(22(32)35)36-17-3-4-18(27-11-17)20(33)14-7-24(25,26)8-14;1-26-22(32)15-13-30(14-15)24-28-10-17(11-29-24)31-9-8-20(23(31)33)34-19-6-7-21(27-12-19)35-18-4-2-16(25)3-5-18;24-15-1-3-17(4-2-15)34-20-6-5-18(11-26-20)33-19-7-8-30(22(19)32)16-9-27-23(28-10-16)29-12-14(13-29)21(25)31;27-21-18(31-17-4-6-20(24-10-17)30-13-14-1-2-14)7-8-26(21)16-3-5-19(23-9-16)25-11-15(12-25)22(28)29;27-19-17(31-16-3-4-18(22-9-16)30-12-13-1-2-13)5-6-26(19)15-7-23-21(24-8-15)25-10-14(11-25)20(28)29;21-20(22,23)11-31-17-4-2-14(8-25-17)32-15-5-6-27(18(15)28)13-1-3-16(24-7-13)26-9-12(10-26)19(29)30;20-19(21,22)10-31-15-2-1-13(7-23-15)32-14-3-4-27(16(14)28)12-5-24-18(25-6-12)26-8-11(9-26)17(29)30/h1-6,13-15,18,21,24,36H,7-12,16-17H2;5-10,13-15,18,23H,3-4,11-12,16-17H2,1-2H3;3-8,11-13,16-17,22H,9-10,14-15H2,1-2H3,(H,31,34);1-6,9-11,15,20H,7-8,12-14H2,(H2,27,34)(H,29,35);3-8,11-13,16,21H,2,9-10,14-15H2,1H3,(H,27,33);3-4,9-11,14-15,19H,5-8,12-13H2,1-2H3;2-7,10-12,15,20H,8-9,13-14H2,1H3,(H,26,32);1-6,9-11,14,19H,7-8,12-13H2,(H2,25,31);3-6,9-10,14-15,18H,1-2,7-8,11-13H2,(H,28,29);3-4,7-9,13-14,17H,1-2,5-6,10-12H2,(H,28,29);1-4,7-8,12,15H,5-6,9-11H2,(H,29,30);1-2,5-7,11,14H,3-4,8-10H2,(H,29,30)/t24-;23-;22-;20-;21-;19-;20-;19-;18-;17-;15-;14-/m111111111111/s1.
What are the key properties of N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid?
N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid has a molecular weight of 5788.81 g/mol, XLogP of 25.09, 92 rotatable bonds, 11 hydrogen bond donors, and 96 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-3-[[6-(cyclopropylmethoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid;N,N-diethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(3,3-difluorocyclobutanecarbonyl)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N,N-dimethylazetidine-3-carboxamide;N-ethyl-1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-1-[2-[3-(4-hydroxypiperidine-1-carbonyl)azetidin-1-yl]pyrimidin-5-yl]pyrrolidin-2-one;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-methylazetidine-3-carboxamide;1-[5-[(3R)-3-[[6-(4-fluorophenoxy)-3-pyridinyl]oxy]-2-oxopyrrolidin-1-yl]pyrimidin-2-yl]-N-propan-2-ylazetidine-3-carboxamide;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]-2-pyridinyl]azetidine-3-carboxylic acid;1-[5-[(3R)-2-oxo-3-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]oxy]pyrrolidin-1-yl]pyrimidin-2-yl]azetidine-3-carboxylic acid is sourced from PubChem (CID 157058825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).