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

C155H201Cl4F10N25O13S — CID 162149414

IUPACN-[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
SMILESCc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cc(F)cc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2ccc(C(C)(C)C)cc2)ncnc1C(=O)N1CCC(N2CCC(N(C)S(C)(=O)=O)CC2)CC1.Cc1c(CCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2cccc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C30H45N5O3S.C25H32Cl2N4O2.C25H32Cl2N4O.C25H30F4N4O2.C25H31F3N4O3.C25H31F3N4O2/c1-22-27(12-9-23-7-10-24(11-8-23)30(2,3)4)31-21-32-28(22)29(36)35-19-15-26(16-20-35)34-17-13-25(14-18-34)33(5)39(6,37)38;1-17-23(4-2-3-18-5-6-21(26)22(27)15-18)28-16-29-24(17)25(33)31-11-7-19(8-12-31)30-13-9-20(32)10-14-30;1-18-23(7-5-6-19-8-9-21(26)22(27)16-19)28-17-29-24(18)25(32)31-14-10-20(11-15-31)30-12-3-2-4-13-30;1-16-22(3-2-17-12-18(25(27,28)29)14-19(26)13-17)30-15-31-23(16)24(35)33-8-4-20(5-9-33)32-10-6-21(34)7-11-32;1-17-22(7-4-18-2-5-21(6-3-18)35-25(26,27)28)29-16-30-23(17)24(34)32-12-8-19(9-13-32)31-14-10-20(33)11-15-31;1-17-22(6-5-18-3-2-4-19(15-18)25(26,27)28)29-16-30-23(17)24(34)32-11-7-20(8-12-32)31-13-9-21(33)10-14-31/h7-8,10-11,21,25-26H,9,12-20H2,1-6H3;5-6,15-16,19-20,32H,2-4,7-14H2,1H3;8-9,16-17,20H,2-7,10-15H2,1H3;12-15,20-21,34H,2-11H2,1H3;2-3,5-6,16,19-20,33H,4,7-15H2,1H3;2-4,15-16,20-21,33H,5-14H2,1H3
InChIKeyZKZMBKWQGOTCHO-UHFFFAOYSA-N
MW2986.33 g/mol
LogP24.48
Rot. Bonds35

About 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

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 (PubChem CID 162149414) has the molecular formula C155H201Cl4F10N25O13S and a molecular weight of 2986.33 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-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.

Molecular Properties

Compound NameN-[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
PubChem CID162149414
Molecular FormulaC155H201Cl4F10N25O13S
Molecular Weight2986.33 g/mol
Exact Mass2982.42
IUPAC NameN-[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
SMILESCc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cc(F)cc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2ccc(C(C)(C)C)cc2)ncnc1C(=O)N1CCC(N2CCC(N(C)S(C)(=O)=O)CC2)CC1.Cc1c(CCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2cccc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1
InChIInChI=1S/C30H45N5O3S.C25H32Cl2N4O2.C25H32Cl2N4O.C25H30F4N4O2.C25H31F3N4O3.C25H31F3N4O2/c1-22-27(12-9-23-7-10-24(11-8-23)30(2,3)4)31-21-32-28(22)29(36)35-19-15-26(16-20-35)34-17-13-25(14-18-34)33(5)39(6,37)38;1-17-23(4-2-3-18-5-6-21(26)22(27)15-18)28-16-29-24(17)25(33)31-11-7-19(8-12-31)30-13-9-20(32)10-14-30;1-18-23(7-5-6-19-8-9-21(26)22(27)16-19)28-17-29-24(18)25(32)31-14-10-20(11-15-31)30-12-3-2-4-13-30;1-16-22(3-2-17-12-18(25(27,28)29)14-19(26)13-17)30-15-31-23(16)24(35)33-8-4-20(5-9-33)32-10-6-21(34)7-11-32;1-17-22(7-4-18-2-5-21(6-3-18)35-25(26,27)28)29-16-30-23(17)24(34)32-12-8-19(9-13-32)31-14-10-20(33)11-15-31;1-17-22(6-5-18-3-2-4-19(15-18)25(26,27)28)29-16-30-23(17)24(34)32-11-7-20(8-12-32)31-13-9-21(33)10-14-31/h7-8,10-11,21,25-26H,9,12-20H2,1-6H3;5-6,15-16,19-20,32H,2-4,7-14H2,1H3;8-9,16-17,20H,2-7,10-15H2,1H3;12-15,20-21,34H,2-11H2,1H3;2-3,5-6,16,19-20,33H,4,7-15H2,1H3;2-4,15-16,20-21,33H,5-14H2,1H3
InChIKeyZKZMBKWQGOTCHO-UHFFFAOYSA-N
XLogP24.48
TPSA423.51 Ų
H-Bond Donors4
H-Bond Acceptors31
Rotatable Bonds35
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002986.33
LogP ≤ 524.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1031

Analyze 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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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-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?
The IUPAC name of 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) is 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.
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-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?
The canonical SMILES for 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 is Cc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCCc2ccc(Cl)c(Cl)c2)ncnc1C(=O)N1CCC(N2CCCCC2)CC1.Cc1c(CCc2cc(F)cc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2ccc(C(C)(C)C)cc2)ncnc1C(=O)N1CCC(N2CCC(N(C)S(C)(=O)=O)CC2)CC1.Cc1c(CCc2ccc(OC(F)(F)F)cc2)ncnc1C(=O)N1CCC(N2CCC(O)CC2)CC1.Cc1c(CCc2cccc(C(F)(F)F)c2)ncnc1C(=O)N1CCC(N2CCC(O)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-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?
The InChIKey is ZKZMBKWQGOTCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H45N5O3S.C25H32Cl2N4O2.C25H32Cl2N4O.C25H30F4N4O2.C25H31F3N4O3.C25H31F3N4O2/c1-22-27(12-9-23-7-10-24(11-8-23)30(2,3)4)31-21-32-28(22)29(36)35-19-15-26(16-20-35)34-17-13-25(14-18-34)33(5)39(6,37)38;1-17-23(4-2-3-18-5-6-21(26)22(27)15-18)28-16-29-24(17)25(33)31-11-7-19(8-12-31)30-13-9-20(32)10-14-30;1-18-23(7-5-6-19-8-9-21(26)22(27)16-19)28-17-29-24(18)25(32)31-14-10-20(11-15-31)30-12-3-2-4-13-30;1-16-22(3-2-17-12-18(25(27,28)29)14-19(26)13-17)30-15-31-23(16)24(35)33-8-4-20(5-9-33)32-10-6-21(34)7-11-32;1-17-22(7-4-18-2-5-21(6-3-18)35-25(26,27)28)29-16-30-23(17)24(34)32-12-8-19(9-13-32)31-14-10-20(33)11-15-31;1-17-22(6-5-18-3-2-4-19(15-18)25(26,27)28)29-16-30-23(17)24(34)32-11-7-20(8-12-32)31-13-9-21(33)10-14-31/h7-8,10-11,21,25-26H,9,12-20H2,1-6H3;5-6,15-16,19-20,32H,2-4,7-14H2,1H3;8-9,16-17,20H,2-7,10-15H2,1H3;12-15,20-21,34H,2-11H2,1H3;2-3,5-6,16,19-20,33H,4,7-15H2,1H3;2-4,15-16,20-21,33H,5-14H2,1H3.
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-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?
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 has a molecular weight of 2986.33 g/mol, XLogP of 24.48, 35 rotatable bonds, 4 hydrogen bond donors, and 31 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-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 is sourced from PubChem (CID 162149414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).