[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

C154H206Cl3F2N25O7 — CID 157138571

IUPAC[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
SMILESCOc1ccc(CCCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1Cl.Cc1c(CCC2CCC(c3ccccc3)CC2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1cc(CCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)ccc1F.Cc1ccc(CNc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1F
InChIInChI=1S/C30H42N4O.C26H35ClN4O2.C25H33ClN4O.C25H33FN4O.C24H31ClN4O.C24H32FN5O/c1-23-28(15-12-24-10-13-26(14-11-24)25-8-4-2-5-9-25)31-22-32-29(23)30(35)34-20-16-27(17-21-34)33-18-6-3-7-19-33;1-19-23(8-6-7-20-9-10-24(33-2)22(27)17-20)28-18-29-25(19)26(32)31-15-11-21(12-16-31)30-13-4-3-5-14-30;1-19-23(10-6-8-20-7-5-9-21(26)17-20)27-18-28-24(19)25(31)30-15-11-22(12-16-30)29-13-3-2-4-14-29;1-18-16-20(6-8-22(18)26)7-9-23-19(2)24(28-17-27-23)25(31)30-14-10-21(11-15-30)29-12-4-3-5-13-29;1-18-22(9-8-19-6-5-7-20(25)16-19)26-17-27-23(18)24(30)29-14-10-21(11-15-29)28-12-3-2-4-13-28;1-17-6-7-19(14-21(17)25)15-26-23-18(2)22(27-16-28-23)24(31)30-12-8-20(9-13-30)29-10-4-3-5-11-29/h2,4-5,8-9,22,24,26-27H,3,6-7,10-21H2,1H3;9-10,17-18,21H,3-8,11-16H2,1-2H3;5,7,9,17-18,22H,2-4,6,8,10-16H2,1H3;6,8,16-17,21H,3-5,7,9-15H2,1-2H3;5-7,16-17,21H,2-4,8-15H2,1H3;6-7,14,16,20H,3-5,8-13,15H2,1-2H3,(H,26,27,28)
InChIKeyAJXMZVHUXNIMAK-UHFFFAOYSA-N
MW2663.86 g/mol
LogP27.56
Rot. Bonds34

About [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone (PubChem CID 157138571) has the molecular formula C154H206Cl3F2N25O7 and a molecular weight of 2663.86 g/mol. Its IUPAC name is [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
PubChem CID157138571
Molecular FormulaC154H206Cl3F2N25O7
Molecular Weight2663.86 g/mol
Exact Mass2660.56
IUPAC Name[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone
SMILESCOc1ccc(CCCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1Cl.Cc1c(CCC2CCC(c3ccccc3)CC2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1cc(CCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)ccc1F.Cc1ccc(CNc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1F
InChIInChI=1S/C30H42N4O.C26H35ClN4O2.C25H33ClN4O.C25H33FN4O.C24H31ClN4O.C24H32FN5O/c1-23-28(15-12-24-10-13-26(14-11-24)25-8-4-2-5-9-25)31-22-32-29(23)30(35)34-20-16-27(17-21-34)33-18-6-3-7-19-33;1-19-23(8-6-7-20-9-10-24(33-2)22(27)17-20)28-18-29-25(19)26(32)31-15-11-21(12-16-31)30-13-4-3-5-14-30;1-19-23(10-6-8-20-7-5-9-21(26)17-20)27-18-28-24(19)25(31)30-15-11-22(12-16-30)29-13-3-2-4-14-29;1-18-16-20(6-8-22(18)26)7-9-23-19(2)24(28-17-27-23)25(31)30-14-10-21(11-15-30)29-12-4-3-5-13-29;1-18-22(9-8-19-6-5-7-20(25)16-19)26-17-27-23(18)24(30)29-14-10-21(11-15-29)28-12-3-2-4-13-28;1-17-6-7-19(14-21(17)25)15-26-23-18(2)22(27-16-28-23)24(31)30-12-8-20(9-13-30)29-10-4-3-5-11-29/h2,4-5,8-9,22,24,26-27H,3,6-7,10-21H2,1H3;9-10,17-18,21H,3-8,11-16H2,1-2H3;5,7,9,17-18,22H,2-4,6,8,10-16H2,1H3;6,8,16-17,21H,3-5,7,9-15H2,1-2H3;5-7,16-17,21H,2-4,8-15H2,1H3;6-7,14,16,20H,3-5,8-13,15H2,1-2H3,(H,26,27,28)
InChIKeyAJXMZVHUXNIMAK-UHFFFAOYSA-N
XLogP27.56
TPSA317.24 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds34
Heavy Atoms191
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002663.86
LogP ≤ 527.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone with MolForge

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Related Compounds

2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;N'-cyano-2-[3-(2-methylpropyl)phenyl]ethanimidamide;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;2-isocyano-4-(2-methylpropyl)pyridine;N-methyl-4-(2-methylpropyl)benzamide;4-(2-methylpropyl)aniline;3-(2-methylpropyl)benzamide;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene;2-(2-methylpropyl)-5-(trifluoromethyl)pyridine;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 157231491
[4-(4-Hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(4-phenylbutyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(3-phenylmethoxypropyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-(5-phenylpentyl)pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)cyclohexyl]methylamino]pyrimidin-4-yl]methanone
CID 157237072
[6-[4-(4-chlorophenyl)piperidin-1-yl]-5-methylpyrimidin-4-yl]-[4-[(3-methoxyoxan-4-yl)amino]piperidin-1-yl]methanone;N-[1-[1-[6-[4-(3-fluorophenyl)piperidin-1-yl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-[1-[1-[6-[4-(4-methoxyphenyl)piperidin-1-yl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[4-(4-methylphenyl)piperidin-1-yl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide;N-methyl-N-[1-[1-[5-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]pyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]methanesulfonamide
CID 157971523
2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;N'-cyano-2-[3-(2-methylpropyl)phenyl]ethanimidamide;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;2-isocyano-4-(2-methylpropyl)pyridine;N-methyl-4-(2-methylpropyl)benzamide;4-(2-methylpropyl)aniline;3-(2-methylpropyl)benzamide;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyridine;5-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 158555976
2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;N'-cyano-2-[3-(2-methylpropyl)phenyl]ethanimidamide;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;2-isocyano-4-(2-methylpropyl)pyridine;N-methyl-4-(2-methylpropyl)benzamide;4-(2-methylpropyl)aniline;3-(2-methylpropyl)benzamide;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene;2-(2-methylpropyl)-5-(trifluoromethyl)pyridine;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 158961573
2-Chloro-4-(2-methylpropyl)pyridine;1-cyano-2-[3-(2-methylpropyl)phenyl]guanidine;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;2,6-dichloro-4-(2-methylpropyl)phenol;2,6-dimethyl-4-(2-methylpropyl)phenol;2-isocyano-4-(2-methylpropyl)pyridine;3-(2-methylpropyl)benzamide;4-(2-methylpropyl)phenol;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-3-(trifluoromethoxy)benzene;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyridine;5-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 159201998
2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;N'-cyano-2-[3-(2-methylpropyl)phenyl]ethanimidamide;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;4-(2,2-dimethylpropyl)-N,N-dimethylbenzamide;4-(2,2-dimethylpropyl)-N-methylbenzamide;2-isocyano-4-(2-methylpropyl)pyridine;4-(2-methylpropyl)aniline;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyridine;5-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 159722823
bis(3-tert-butyl-N,5-di(propan-2-yl)benzamide);2-tert-butyl-6-(1-methylcyclopropyl)-4-propan-2-ylpyridine;2-tert-butyl-4-(1-methylcyclopropyl)-6-propan-2-ylpyrimidine;4-tert-butyl-2-(1-methylcyclopropyl)-6-propan-2-ylpyrimidine;3-tert-butyl-N-methyl-N,5-di(propan-2-yl)benzamide;1-chloro-3-(1-methylcyclopropyl)-5-propan-2-ylbenzene;N,3-ditert-butyl-N-methyl-5-propan-2-ylbenzamide;N,6-ditert-butyl-N-methyl-4-propan-2-ylpyridine-2-carboxamide;N,6-ditert-butyl-4-propan-2-ylpyridine-2-carboxamide;1-(2,2-dimethylpropyl)-5-propan-2-yl-3-(trifluoromethyl)pyridin-2-one;1-(1-methylcyclopropyl)-3-propan-2-yl-5-(trifluoromethoxy)benzene
CID 160162453
[6-[2-(4-Tert-butylphenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[[3-fluoro-4-(trifluoromethyl)phenyl]methylamino]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[3-(trifluoromethoxy)phenyl]methylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[3-(trifluoromethyl)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethyl)phenyl]ethylamino]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]methanone
CID 161374622
2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;1-cyano-2-[3-(2-methylpropyl)phenyl]guanidine;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;4-(2,2-dimethylpropyl)-N,N-dimethylbenzamide;4-(2,2-dimethylpropyl)-N-methylbenzamide;2-isocyano-4-(2-methylpropyl)pyridine;4-(2-methylpropyl)aniline;3-(2-methylpropyl)benzamide;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyridine;5-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 161442345
[6-[2-(4-Chloro-3-fluorophenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-(3-chloro-4-methoxyphenyl)ethylamino]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-[3-chloro-4-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[3-(3,4-difluorophenyl)propyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-(3-fluoro-4-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-(3-phenylcyclohexyl)ethyl]pyrimidin-4-yl]methanone
CID 161918456
N-[1-[1-[6-[2-(4-tert-butylphenyl)ethyl]-5-methylpyrimidine-4-carbonyl]piperidin-4-yl]piperidin-4-yl]-N-methylmethanesulfonamide;[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[6-[3-(3,4-dichlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethyl]-5-methylpyrimidin-4-yl]-[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[4-(trifluoromethoxy)phenyl]ethyl]pyrimidin-4-yl]methanone;[4-(4-hydroxypiperidin-1-yl)piperidin-1-yl]-[5-methyl-6-[2-[3-(trifluoromethyl)phenyl]ethyl]pyrimidin-4-yl]methanone
CID 162149414

Frequently Asked Questions

What is the IUPAC name of [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The IUPAC name of [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone (CID 157138571) is [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The canonical SMILES for [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone is COc1ccc(CCCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1Cl.Cc1c(CCC2CCC(c3ccccc3)CC2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cccc(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1cc(CCc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)ccc1F.Cc1ccc(CNc2ncnc(C(=O)N3CCC(N4CCCCC4)CC3)c2C)cc1F.
What is the InChIKey of [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone?
The InChIKey is AJXMZVHUXNIMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H42N4O.C26H35ClN4O2.C25H33ClN4O.C25H33FN4O.C24H31ClN4O.C24H32FN5O/c1-23-28(15-12-24-10-13-26(14-11-24)25-8-4-2-5-9-25)31-22-32-29(23)30(35)34-20-16-27(17-21-34)33-18-6-3-7-19-33;1-19-23(8-6-7-20-9-10-24(33-2)22(27)17-20)28-18-29-25(19)26(32)31-15-11-21(12-16-31)30-13-4-3-5-14-30;1-19-23(10-6-8-20-7-5-9-21(26)17-20)27-18-28-24(19)25(31)30-15-11-22(12-16-30)29-13-3-2-4-14-29;1-18-16-20(6-8-22(18)26)7-9-23-19(2)24(28-17-27-23)25(31)30-14-10-21(11-15-30)29-12-4-3-5-13-29;1-18-22(9-8-19-6-5-7-20(25)16-19)26-17-27-23(18)24(30)29-14-10-21(11-15-29)28-12-3-2-4-13-28;1-17-6-7-19(14-21(17)25)15-26-23-18(2)22(27-16-28-23)24(31)30-12-8-20(9-13-30)29-10-4-3-5-11-29/h2,4-5,8-9,22,24,26-27H,3,6-7,10-21H2,1H3;9-10,17-18,21H,3-8,11-16H2,1-2H3;5,7,9,17-18,22H,2-4,6,8,10-16H2,1H3;6,8,16-17,21H,3-5,7,9-15H2,1-2H3;5-7,16-17,21H,2-4,8-15H2,1H3;6-7,14,16,20H,3-5,8-13,15H2,1-2H3,(H,26,27,28).
What are the key properties of [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone?
[6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone has a molecular weight of 2663.86 g/mol, XLogP of 27.56, 34 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[3-(3-chloro-4-methoxyphenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(3-chlorophenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[3-(3-chlorophenyl)propyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[2-(4-fluoro-3-methylphenyl)ethyl]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[6-[(3-fluoro-4-methylphenyl)methylamino]-5-methylpyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone;[5-methyl-6-[2-(4-phenylcyclohexyl)ethyl]pyrimidin-4-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 157138571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).