potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium

C275H334ClF24I2K3N26O26 — CID 158044002

IUPACpotassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium
SMILESC.C.C.C.C.C.C.C.C.C#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(=O)O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(N)=O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(Cl)n3)cc2)CC1.COC(=O)C1(c2ccccc2C#Cc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2I)CCC1.NC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCNCC4)cc3)ncc2C(F)(F)F)CCC1.O=C(O)C1(c2ccccc2I)CCC1.[H-].[K+].[K][K]
InChIInChI=1S/C36H42F3N3O4.C36H38F3N3O4.C35H41F3N4O3.C35H40F3N3O4.C30H33F3N4O.C25H28F3N3O2.C24H26F3N3O2.C22H25ClF3N3O2.C12H13IO2.C11H11IO2.9CH4.3K.H/c2*1-34(2,3)46-33(44)42-20-16-26(17-21-42)25-12-10-24(11-13-25)22-31-40-23-29(36(37,38)39)30(41-31)15-14-27-8-5-6-9-28(27)35(18-7-19-35)32(43)45-4;1-33(2,3)45-32(44)42-19-15-25(16-20-42)24-11-9-23(10-12-24)21-30-40-22-28(35(36,37)38)29(41-30)14-13-26-7-4-5-8-27(26)34(31(39)43)17-6-18-34;1-33(2,3)45-32(44)41-19-15-25(16-20-41)24-11-9-23(10-12-24)21-30-39-22-28(35(36,37)38)29(40-30)14-13-26-7-4-5-8-27(26)34(31(42)43)17-6-18-34;31-30(32,33)25-19-36-27(18-20-6-8-21(9-7-20)22-12-16-35-17-13-22)37-26(25)11-10-23-4-1-2-5-24(23)29(28(34)38)14-3-15-29;1-5-6-21-20(25(26,27)28)16-29-22(30-21)15-17-7-9-18(10-8-17)19-11-13-31(14-12-19)23(32)33-24(2,3)4;1-5-20-19(24(25,26)27)15-28-21(29-20)14-16-6-8-17(9-7-16)18-10-12-30(13-11-18)22(31)32-23(2,3)4;1-21(2,3)31-20(30)29-10-8-16(9-11-29)15-6-4-14(5-7-15)12-18-27-13-17(19(23)28-18)22(24,25)26;1-15-11(14)12(7-4-8-12)9-5-2-3-6-10(9)13;12-9-5-2-1-4-8(9)11(10(13)14)6-3-7-11;;;;;;;;;;;;;/h5-6,8-13,23,26H,7,14-22H2,1-4H3;5-6,8-13,23,26H,7,16-22H2,1-4H3;4-5,7-12,22,25H,6,13-21H2,1-3H3,(H2,39,43);4-5,7-12,22,25H,6,13-21H2,1-3H3,(H,42,43);1-2,4-9,19,22,35H,3,10-18H2,(H2,34,38);7-10,16,19H,11-15H2,1-4H3;1,6-9,15,18H,10-14H2,2-4H3;4-7,13,16H,8-12H2,1-3H3;2-3,5-6H,4,7-8H2,1H3;1-2,4-5H,3,6-7H2,(H,13,14);9*1H4;;;;/q;;;;;;;;;;;;;;;;;;;;;+1;-1
InChIKeyOYORFODSLSPWSB-UHFFFAOYSA-N
MW5282.36 g/mol
LogP58.78
Rot. Bonds50

About potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium

potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium (PubChem CID 158044002) has the molecular formula C275H334ClF24I2K3N26O26 and a molecular weight of 5282.36 g/mol. Its IUPAC name is potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium.

Molecular Properties

Compound Namepotassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium
PubChem CID158044002
Molecular FormulaC275H334ClF24I2K3N26O26
Molecular Weight5282.36 g/mol
Exact Mass5278.19
IUPAC Namepotassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium
SMILESC.C.C.C.C.C.C.C.C.C#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(=O)O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(N)=O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(Cl)n3)cc2)CC1.COC(=O)C1(c2ccccc2C#Cc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2I)CCC1.NC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCNCC4)cc3)ncc2C(F)(F)F)CCC1.O=C(O)C1(c2ccccc2I)CCC1.[H-].[K+].[K][K]
InChIInChI=1S/C36H42F3N3O4.C36H38F3N3O4.C35H41F3N4O3.C35H40F3N3O4.C30H33F3N4O.C25H28F3N3O2.C24H26F3N3O2.C22H25ClF3N3O2.C12H13IO2.C11H11IO2.9CH4.3K.H/c2*1-34(2,3)46-33(44)42-20-16-26(17-21-42)25-12-10-24(11-13-25)22-31-40-23-29(36(37,38)39)30(41-31)15-14-27-8-5-6-9-28(27)35(18-7-19-35)32(43)45-4;1-33(2,3)45-32(44)42-19-15-25(16-20-42)24-11-9-23(10-12-24)21-30-40-22-28(35(36,37)38)29(41-30)14-13-26-7-4-5-8-27(26)34(31(39)43)17-6-18-34;1-33(2,3)45-32(44)41-19-15-25(16-20-41)24-11-9-23(10-12-24)21-30-39-22-28(35(36,37)38)29(40-30)14-13-26-7-4-5-8-27(26)34(31(42)43)17-6-18-34;31-30(32,33)25-19-36-27(18-20-6-8-21(9-7-20)22-12-16-35-17-13-22)37-26(25)11-10-23-4-1-2-5-24(23)29(28(34)38)14-3-15-29;1-5-6-21-20(25(26,27)28)16-29-22(30-21)15-17-7-9-18(10-8-17)19-11-13-31(14-12-19)23(32)33-24(2,3)4;1-5-20-19(24(25,26)27)15-28-21(29-20)14-16-6-8-17(9-7-16)18-10-12-30(13-11-18)22(31)32-23(2,3)4;1-21(2,3)31-20(30)29-10-8-16(9-11-29)15-6-4-14(5-7-15)12-18-27-13-17(19(23)28-18)22(24,25)26;1-15-11(14)12(7-4-8-12)9-5-2-3-6-10(9)13;12-9-5-2-1-4-8(9)11(10(13)14)6-3-7-11;;;;;;;;;;;;;/h5-6,8-13,23,26H,7,14-22H2,1-4H3;5-6,8-13,23,26H,7,16-22H2,1-4H3;4-5,7-12,22,25H,6,13-21H2,1-3H3,(H2,39,43);4-5,7-12,22,25H,6,13-21H2,1-3H3,(H,42,43);1-2,4-9,19,22,35H,3,10-18H2,(H2,34,38);7-10,16,19H,11-15H2,1-4H3;1,6-9,15,18H,10-14H2,2-4H3;4-7,13,16H,8-12H2,1-3H3;2-3,5-6H,4,7-8H2,1H3;1-2,4-5H,3,6-7H2,(H,13,14);9*1H4;;;;/q;;;;;;;;;;;;;;;;;;;;;+1;-1
InChIKeyOYORFODSLSPWSB-UHFFFAOYSA-N
XLogP58.78
TPSA664.73 Ų
H-Bond Donors5
H-Bond Acceptors41
Rotatable Bonds50
Heavy Atoms357
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005282.36
LogP ≤ 558.78
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1041

Analyze potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium with MolForge

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Related Compounds

CID 162098481
CID 162098481
2-[3-[2-[2-[[4-(1-methylpiperidin-4-yl)phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]pyrazin-2-yl]acetamide;2-[3-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]pyrazin-2-yl]acetamide
CID 160922341
tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclopropyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]pyrazol-1-yl]piperidine-1-carboxylate
CID 86712347
2-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]-3-pyridinyl]acetamide
CID 161007880
CID 158176666
CID 158176666
1-[2-[2-[2-[(6-butan-2-yl-3-pyridinyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclopropane-1-carboxamide
CID 161312581
2-[4-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]pyrimidin-5-yl]acetamide
CID 158176667
tert-butyl 4-[4-[[4-[2-[2-(2-amino-2-oxoethyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3-ethylphenyl]piperidine-1-carboxylate
CID 71232246
lithium;acetic acid;tert-butyl 4-[4-[[4-(2-phenylethyl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]phenyl]piperidine-1-carboxylate
CID 174711740
2-[2-[2-[2-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]anilino]-5-(trifluoromethyl)pyrimidin-4-yl]ethynyl]-4-(trifluoromethyl)phenyl]acetic acid
CID 118303810
tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3-ethylphenyl]piperidine-1-carboxylate
CID 86675844
methyl 2-[2-[2-[2-[(4-propan-2-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethynyl]phenyl]acetate
CID 161305680

Frequently Asked Questions

What is the IUPAC name of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium?
The IUPAC name of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium (CID 158044002) is potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium.
What is the SMILES notation for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium?
The canonical SMILES for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium is C.C.C.C.C.C.C.C.C.C#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC#Cc1nc(Cc2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)cc2)ncc1C(F)(F)F.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(=O)O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(CCc4ccccc4C4(C(N)=O)CCC4)n3)cc2)CC1.CC(C)(C)OC(=O)N1CCC(c2ccc(Cc3ncc(C(F)(F)F)c(Cl)n3)cc2)CC1.COC(=O)C1(c2ccccc2C#Cc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCN(C(=O)OC(C)(C)C)CC4)cc3)ncc2C(F)(F)F)CCC1.COC(=O)C1(c2ccccc2I)CCC1.NC(=O)C1(c2ccccc2CCc2nc(Cc3ccc(C4CCNCC4)cc3)ncc2C(F)(F)F)CCC1.O=C(O)C1(c2ccccc2I)CCC1.[H-].[K+].[K][K].
What is the InChIKey of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium?
The InChIKey is OYORFODSLSPWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H42F3N3O4.C36H38F3N3O4.C35H41F3N4O3.C35H40F3N3O4.C30H33F3N4O.C25H28F3N3O2.C24H26F3N3O2.C22H25ClF3N3O2.C12H13IO2.C11H11IO2.9CH4.3K.H/c2*1-34(2,3)46-33(44)42-20-16-26(17-21-42)25-12-10-24(11-13-25)22-31-40-23-29(36(37,38)39)30(41-31)15-14-27-8-5-6-9-28(27)35(18-7-19-35)32(43)45-4;1-33(2,3)45-32(44)42-19-15-25(16-20-42)24-11-9-23(10-12-24)21-30-40-22-28(35(36,37)38)29(41-30)14-13-26-7-4-5-8-27(26)34(31(39)43)17-6-18-34;1-33(2,3)45-32(44)41-19-15-25(16-20-41)24-11-9-23(10-12-24)21-30-39-22-28(35(36,37)38)29(40-30)14-13-26-7-4-5-8-27(26)34(31(42)43)17-6-18-34;31-30(32,33)25-19-36-27(18-20-6-8-21(9-7-20)22-12-16-35-17-13-22)37-26(25)11-10-23-4-1-2-5-24(23)29(28(34)38)14-3-15-29;1-5-6-21-20(25(26,27)28)16-29-22(30-21)15-17-7-9-18(10-8-17)19-11-13-31(14-12-19)23(32)33-24(2,3)4;1-5-20-19(24(25,26)27)15-28-21(29-20)14-16-6-8-17(9-7-16)18-10-12-30(13-11-18)22(31)32-23(2,3)4;1-21(2,3)31-20(30)29-10-8-16(9-11-29)15-6-4-14(5-7-15)12-18-27-13-17(19(23)28-18)22(24,25)26;1-15-11(14)12(7-4-8-12)9-5-2-3-6-10(9)13;12-9-5-2-1-4-8(9)11(10(13)14)6-3-7-11;;;;;;;;;;;;;/h5-6,8-13,23,26H,7,14-22H2,1-4H3;5-6,8-13,23,26H,7,16-22H2,1-4H3;4-5,7-12,22,25H,6,13-21H2,1-3H3,(H2,39,43);4-5,7-12,22,25H,6,13-21H2,1-3H3,(H,42,43);1-2,4-9,19,22,35H,3,10-18H2,(H2,34,38);7-10,16,19H,11-15H2,1-4H3;1,6-9,15,18H,10-14H2,2-4H3;4-7,13,16H,8-12H2,1-3H3;2-3,5-6H,4,7-8H2,1H3;1-2,4-5H,3,6-7H2,(H,13,14);9*1H4;;;;/q;;;;;;;;;;;;;;;;;;;;;+1;-1.
What are the key properties of potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium?
potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium has a molecular weight of 5282.36 g/mol, XLogP of 58.78, 50 rotatable bonds, 5 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;tert-butyl 4-[4-[[4-[2-[2-(1-carbamoylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-ethynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-[2-[2-(1-methoxycarbonylcyclobutyl)phenyl]ethynyl]-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;tert-butyl 4-[4-[[4-prop-1-ynyl-5-(trifluoromethyl)pyrimidin-2-yl]methyl]phenyl]piperidine-1-carboxylate;hydride;1-(2-iodophenyl)cyclobutane-1-carboxylic acid;methane;methyl 1-(2-iodophenyl)cyclobutane-1-carboxylate;1-[2-[2-[2-[[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]phenyl]methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxylic acid;1-[2-[2-[2-[(4-piperidin-4-ylphenyl)methyl]-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]cyclobutane-1-carboxamide;potassiopotassium is sourced from PubChem (CID 158044002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).