N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide

C146H214Cl4N28O15S5 — CID 158348828

IUPACN-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(C(C)(C)C)cc4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCC4CCCN(c5ccccc5)C4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCc4ccc(C(C)C)cc4)c3C)CC2)CC1
InChIInChI=1S/C31H47N7O3S.C31H47N5O3S.C29H44N6O3S.C28H39Cl2N5O3S.C27H37Cl2N5O3S/c1-4-42(40,41)35(3)26-12-17-36(18-13-26)28-14-19-37(20-15-28)31(39)29-24(2)30(34-23-33-29)32-21-25-9-8-16-38(22-25)27-10-6-5-7-11-27;1-7-40(38,39)34(6)26-14-18-35(19-15-26)27-16-20-36(21-17-27)30(37)29-23(2)28(32-22-33-29)13-10-24-8-11-25(12-9-24)31(3,4)5;1-6-39(37,38)33(5)25-11-15-34(16-12-25)26-13-17-35(18-14-26)29(36)27-22(4)28(32-20-31-27)30-19-23-7-9-24(10-8-23)21(2)3;1-4-39(37,38)33(3)22-10-14-34(15-11-22)23-12-16-35(17-13-23)28(36)27-20(2)26(31-19-32-27)7-5-6-21-8-9-24(29)25(30)18-21;1-4-38(36,37)32(3)21-9-13-33(14-10-21)22-11-15-34(16-12-22)27(35)26-19(2)25(30-18-31-26)8-6-20-5-7-23(28)24(29)17-20/h5-7,10-11,23,25-26,28H,4,8-9,12-22H2,1-3H3,(H,32,33,34);8-9,11-12,22,26-27H,7,10,13-21H2,1-6H3;7-10,20-21,25-26H,6,11-19H2,1-5H3,(H,30,31,32);8-9,18-19,22-23H,4-7,10-17H2,1-3H3;5,7,17-18,21-22H,4,6,8-16H2,1-3H3
InChIKeyGSBIPLAFSBHRIQ-UHFFFAOYSA-N
MW2903.65 g/mol
LogP20.40
Rot. Bonds43

About N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide

N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide (PubChem CID 158348828) has the molecular formula C146H214Cl4N28O15S5 and a molecular weight of 2903.65 g/mol. Its IUPAC name is N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide.

Molecular Properties

Compound NameN-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide
PubChem CID158348828
Molecular FormulaC146H214Cl4N28O15S5
Molecular Weight2903.65 g/mol
Exact Mass2899.42
IUPAC NameN-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(C(C)(C)C)cc4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCC4CCCN(c5ccccc5)C4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCc4ccc(C(C)C)cc4)c3C)CC2)CC1
InChIInChI=1S/C31H47N7O3S.C31H47N5O3S.C29H44N6O3S.C28H39Cl2N5O3S.C27H37Cl2N5O3S/c1-4-42(40,41)35(3)26-12-17-36(18-13-26)28-14-19-37(20-15-28)31(39)29-24(2)30(34-23-33-29)32-21-25-9-8-16-38(22-25)27-10-6-5-7-11-27;1-7-40(38,39)34(6)26-14-18-35(19-15-26)27-16-20-36(21-17-27)30(37)29-23(2)28(32-22-33-29)13-10-24-8-11-25(12-9-24)31(3,4)5;1-6-39(37,38)33(5)25-11-15-34(16-12-25)26-13-17-35(18-14-26)29(36)27-22(4)28(32-20-31-27)30-19-23-7-9-24(10-8-23)21(2)3;1-4-39(37,38)33(3)22-10-14-34(15-11-22)23-12-16-35(17-13-23)28(36)27-20(2)26(31-19-32-27)7-5-6-21-8-9-24(29)25(30)18-21;1-4-38(36,37)32(3)21-9-13-33(14-10-21)22-11-15-34(16-12-22)27(35)26-19(2)25(30-18-31-26)8-6-20-5-7-23(28)24(29)17-20/h5-7,10-11,23,25-26,28H,4,8-9,12-22H2,1-3H3,(H,32,33,34);8-9,11-12,22,26-27H,7,10,13-21H2,1-6H3;7-10,20-21,25-26H,6,11-19H2,1-5H3,(H,30,31,32);8-9,18-19,22-23H,4-7,10-17H2,1-3H3;5,7,17-18,21-22H,4,6,8-16H2,1-3H3
InChIKeyGSBIPLAFSBHRIQ-UHFFFAOYSA-N
XLogP20.40
TPSA460.85 Ų
H-Bond Donors2
H-Bond Acceptors33
Rotatable Bonds43
Heavy Atoms198
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002903.65
LogP ≤ 520.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1033

Analyze N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide with MolForge

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Launch Full Analysis

Related Compounds

N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]azepan-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-morpholin-4-ylazepan-1-yl)methanone;[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-pyrrolidin-1-ylazepan-1-yl)methanone;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-ethylmethanesulfonamide;[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidin-4-yl]-[4-(4,4-difluoropiperidin-1-yl)piperidin-1-yl]methanone;N-methyl-N-[1-[1-[5-methyl-6-[2-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide
CID 157354804
N-[1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-2,5-dimethylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;(3R)-1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]-N-methylpyrrolidine-3-carboxamide;N-[1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-[1-[1-[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-2,5-dimethylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;(3R)-1-[1-[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]-N-methylpyrrolidine-3-carboxamide
CID 157809697
[6-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-(3-chloro-4-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;N-[1-[1-[6-[2-(4-chlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[[3-chloro-4-(trifluoromethyl)phenyl]methylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide
CID 158147658
[6-[3-(4-Tert-butylphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chloro-4-fluorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-chloro-3-fluorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3,4-difluorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(3-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(1-phenylpiperidin-4-yl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
CID 158835075
N-[1-[1-[6-[2-(3-chloro-4-methylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[2-(1-phenylpiperidin-4-yl)ethyl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[2-(1-phenylpyrrolidin-3-yl)ethyl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-[1-[1-[5-methyl-6-[2-(1-phenylpyrrolidin-3-yl)ethyl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide
CID 159062595
N-[1-[1-[6-[4-(3-chlorophenyl)piperidin-1-yl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[4-(4-chlorophenyl)piperidin-1-yl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-(4-phenylpiperidin-1-yl)pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide
CID 159157731
N-[1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-2,5-dimethylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;(3R)-1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]-N-methylpyrrolidine-3-carboxamide;N-[1-[1-[6-[2-(4-chloro-3-fluorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-[1-[1-[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-2,5-dimethylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;(3R)-1-[1-[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]-N-methylpyrrolidine-3-carboxamide;N-[1-[1-[2,5-dimethyl-6-[(3-phenylcyclohexyl)methyl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide
CID 159985774
[6-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-(3-chloro-4-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;N-[1-[1-[6-[2-(4-chlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[[3-chloro-4-(trifluoromethyl)phenyl]methylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;[6-(cyclohexylmethyl)-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]pyrimidin-4-yl]methanone
CID 161826561
[6-[2-(3,4-Dichlorophenyl)ethylamino]-5-ethylpyrimidin-4-yl]-(4-morpholin-4-ylpiperidin-1-yl)methanone;[6-[2-(3,4-dichlorophenyl)ethylamino]-5-methylpyrimidin-4-yl]-[4-(4-methylsulfonylpiperazin-1-yl)piperidin-1-yl]methanone;1-[4-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperazin-1-yl]-2-methylpropan-1-one;[5-ethyl-6-[(3-phenylphenyl)methylamino]pyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone
CID 157162061
[6-[2-(4-Chloro-3-fluorophenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-methoxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[(3,4-dichlorophenyl)methylamino]-2,5-dimethylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[3-(3,4-dichlorophenyl)propyl]-2,5-dimethylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[4-(4-methoxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-(4-propan-2-ylphenyl)ethyl]pyrimidin-4-yl]methanone;1-[1-[1-[5-methyl-6-[(1-phenylpyrrolidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]propan-1-one
CID 157499539
1-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]propan-1-one;[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]urea;[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]piperidin-1-yl]methanone;[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-[(3R,4R)-3-methoxy-4-(methylsulfonylmethyl)piperidin-1-yl]piperidin-1-yl]methanone
CID 157695111
[6-[(4-tert-butylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-morpholin-4-ylpiperidin-1-yl)methanone;N-[1-[1-[6-[(6-tert-butyl-3-pyridinyl)methylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[(4-ethylphenyl)methylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[(4-fluoro-3-methylphenyl)methylamino]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide
CID 157701984

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide?
The IUPAC name of N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide (CID 158348828) is N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide.
What is the SMILES notation for N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide?
The canonical SMILES for N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide is CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(C(C)(C)C)cc4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(CCc4ccc(Cl)c(Cl)c4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCC4CCCN(c5ccccc5)C4)c3C)CC2)CC1.CCS(=O)(=O)N(C)C1CCN(C2CCN(C(=O)c3ncnc(NCc4ccc(C(C)C)cc4)c3C)CC2)CC1.
What is the InChIKey of N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide?
The InChIKey is GSBIPLAFSBHRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H47N7O3S.C31H47N5O3S.C29H44N6O3S.C28H39Cl2N5O3S.C27H37Cl2N5O3S/c1-4-42(40,41)35(3)26-12-17-36(18-13-26)28-14-19-37(20-15-28)31(39)29-24(2)30(34-23-33-29)32-21-25-9-8-16-38(22-25)27-10-6-5-7-11-27;1-7-40(38,39)34(6)26-14-18-35(19-15-26)27-16-20-36(21-17-27)30(37)29-23(2)28(32-22-33-29)13-10-24-8-11-25(12-9-24)31(3,4)5;1-6-39(37,38)33(5)25-11-15-34(16-12-25)26-13-17-35(18-14-26)29(36)27-22(4)28(32-20-31-27)30-19-23-7-9-24(10-8-23)21(2)3;1-4-39(37,38)33(3)22-10-14-34(15-11-22)23-12-16-35(17-13-23)28(36)27-20(2)26(31-19-32-27)7-5-6-21-8-9-24(29)25(30)18-21;1-4-38(36,37)32(3)21-9-13-33(14-10-21)22-11-15-34(16-12-22)27(35)26-19(2)25(30-18-31-26)8-6-20-5-7-23(28)24(29)17-20/h5-7,10-11,23,25-26,28H,4,8-9,12-22H2,1-3H3,(H,32,33,34);8-9,11-12,22,26-27H,7,10,13-21H2,1-6H3;7-10,20-21,25-26H,6,11-19H2,1-5H3,(H,30,31,32);8-9,18-19,22-23H,4-7,10-17H2,1-3H3;5,7,17-18,21-22H,4,6,8-16H2,1-3H3.
What are the key properties of N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide?
N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide has a molecular weight of 2903.65 g/mol, XLogP of 20.40, 43 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[2-(3,4-dichlorophenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-[1-[1-[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(1-phenylpiperidin-3-yl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[(4-propan-2-ylphenyl)methylamino]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]ethanesulfonamide is sourced from PubChem (CID 158348828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).