N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide

C249H321F6N21O20 — CID 161136595

IUPACN-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)c(F)c1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC(C)C)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4(F)F)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)cc1.CCCOc1ccc(C2CCN(c3ccc(C(C)NC(C)=O)cc3F)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)cc1.C[C@H](NC(=O)N(C)C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1
InChIInChI=1S/C26H35N3O2.2C25H30F2N2O2.C25H31FN2O2.C25H33FN2O2.2C25H32N2O2.C25H34N2O2.2C24H32N2O2/c1-19(27-26(30)28(2)3)20-7-11-23(12-8-20)29-17-15-22(16-18-29)21-9-13-25(14-10-21)31-24-5-4-6-24;1-17(28-18(2)30)19-3-7-23(8-4-19)29-13-11-21(12-14-29)20-5-9-24(10-6-20)31-16-22-15-25(22,26)27;1-16(28-17(2)30)20-5-8-25(24(27)13-20)29-11-9-19(10-12-29)22-7-6-21(14-23(22)26)31-15-18-3-4-18;1-17(27-18(2)29)20-5-7-22(8-6-20)28-13-11-21(12-14-28)24-10-9-23(15-25(24)26)30-16-19-3-4-19;1-5-14-30-22-7-8-23(17(2)15-22)20-10-12-28(13-11-20)25-9-6-21(16-24(25)26)18(3)27-19(4)29;1-18(26-19(2)28)21-5-9-24(10-6-21)27-15-13-23(14-16-27)22-7-11-25(12-8-22)29-17-20-3-4-20;1-18(26-19(2)28)20-6-10-23(11-7-20)27-16-14-22(15-17-27)21-8-12-25(13-9-21)29-24-4-3-5-24;1-5-16-29-24-10-11-25(18(2)17-24)22-12-14-27(15-13-22)23-8-6-21(7-9-23)19(3)26-20(4)28;1-17(2)28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(3)25-19(4)27;1-4-17-28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(2)25-19(3)27/h7-14,19,22,24H,4-6,15-18H2,1-3H3,(H,27,30);3-10,17,21-22H,11-16H2,1-2H3,(H,28,30);5-8,13-14,16,18-19H,3-4,9-12,15H2,1-2H3,(H,28,30);5-10,15,17,19,21H,3-4,11-14,16H2,1-2H3,(H,27,29);6-9,15-16,18,20H,5,10-14H2,1-4H3,(H,27,29);5-12,18,20,23H,3-4,13-17H2,1-2H3,(H,26,28);6-13,18,22,24H,3-5,14-17H2,1-2H3,(H,26,28);6-11,17,19,22H,5,12-16H2,1-4H3,(H,26,28);5-12,17-18,22H,13-16H2,1-4H3,(H,25,27);5-12,18,22H,4,13-17H2,1-3H3,(H,25,27)/t19-;17-,22?;;17-;;2*18-;19-;2*18-/m00.0.00000/s1
InChIKeyUMWNOSZZJXGEKA-CFQSYIPKSA-N
MW4042.42 g/mol
LogP52.40
Rot. Bonds67

About N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide

N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide (PubChem CID 161136595) has the molecular formula C249H321F6N21O20 and a molecular weight of 4042.42 g/mol. Its IUPAC name is N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide
PubChem CID161136595
Molecular FormulaC249H321F6N21O20
Molecular Weight4042.42 g/mol
Exact Mass4039.47
IUPAC NameN-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)c(F)c1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC(C)C)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4(F)F)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)cc1.CCCOc1ccc(C2CCN(c3ccc(C(C)NC(C)=O)cc3F)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)cc1.C[C@H](NC(=O)N(C)C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1
InChIInChI=1S/C26H35N3O2.2C25H30F2N2O2.C25H31FN2O2.C25H33FN2O2.2C25H32N2O2.C25H34N2O2.2C24H32N2O2/c1-19(27-26(30)28(2)3)20-7-11-23(12-8-20)29-17-15-22(16-18-29)21-9-13-25(14-10-21)31-24-5-4-6-24;1-17(28-18(2)30)19-3-7-23(8-4-19)29-13-11-21(12-14-29)20-5-9-24(10-6-20)31-16-22-15-25(22,26)27;1-16(28-17(2)30)20-5-8-25(24(27)13-20)29-11-9-19(10-12-29)22-7-6-21(14-23(22)26)31-15-18-3-4-18;1-17(27-18(2)29)20-5-7-22(8-6-20)28-13-11-21(12-14-28)24-10-9-23(15-25(24)26)30-16-19-3-4-19;1-5-14-30-22-7-8-23(17(2)15-22)20-10-12-28(13-11-20)25-9-6-21(16-24(25)26)18(3)27-19(4)29;1-18(26-19(2)28)21-5-9-24(10-6-21)27-15-13-23(14-16-27)22-7-11-25(12-8-22)29-17-20-3-4-20;1-18(26-19(2)28)20-6-10-23(11-7-20)27-16-14-22(15-17-27)21-8-12-25(13-9-21)29-24-4-3-5-24;1-5-16-29-24-10-11-25(18(2)17-24)22-12-14-27(15-13-22)23-8-6-21(7-9-23)19(3)26-20(4)28;1-17(2)28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(3)25-19(4)27;1-4-17-28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(2)25-19(3)27/h7-14,19,22,24H,4-6,15-18H2,1-3H3,(H,27,30);3-10,17,21-22H,11-16H2,1-2H3,(H,28,30);5-8,13-14,16,18-19H,3-4,9-12,15H2,1-2H3,(H,28,30);5-10,15,17,19,21H,3-4,11-14,16H2,1-2H3,(H,27,29);6-9,15-16,18,20H,5,10-14H2,1-4H3,(H,27,29);5-12,18,20,23H,3-4,13-17H2,1-2H3,(H,26,28);6-13,18,22,24H,3-5,14-17H2,1-2H3,(H,26,28);6-11,17,19,22H,5,12-16H2,1-4H3,(H,26,28);5-12,17-18,22H,13-16H2,1-4H3,(H,25,27);5-12,18,22H,4,13-17H2,1-3H3,(H,25,27)/t19-;17-,22?;;17-;;2*18-;19-;2*18-/m00.0.00000/s1
InChIKeyUMWNOSZZJXGEKA-CFQSYIPKSA-N
XLogP52.40
TPSA418.94 Ų
H-Bond Donors10
H-Bond Acceptors30
Rotatable Bonds67
Heavy Atoms296
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004042.42
LogP ≤ 552.40
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1030

Analyze N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide with MolForge

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Related Compounds

4-[4-(4-Tert-butylphenyl)piperazin-1-yl]-1-[4-[4-methyl-3-(trifluoromethyl)anilino]piperidin-1-yl]butan-1-one;3-[4-(4-tert-butylphenyl)piperazin-1-yl]-1-[4-[4-methyl-3-(trifluoromethyl)anilino]piperidin-1-yl]propan-1-one;4-[4-(4-methylphenyl)piperazin-1-yl]-1-[4-[4-methyl-3-(trifluoromethyl)anilino]piperidin-1-yl]butan-1-one;1-[4-(4-methylphenyl)piperazin-1-yl]-3-[4-[4-methyl-3-(trifluoromethyl)anilino]piperidin-1-yl]propane-1,3-dione;4-[4-(4-methylphenyl)piperazin-1-yl]-1-[4-[4-methyl-3-(trifluoromethyl)phenoxy]piperidin-1-yl]butan-1-one;3-[4-(4-methylphenyl)piperidin-1-yl]-1-[4-[4-methyl-3-(trifluoromethyl)anilino]piperidin-1-yl]propan-1-one
CID 158531766
N-[1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]-2-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-ethoxyphenyl)piperidin-1-yl]phenyl]ethyl]-2,2-difluoropropanamide;N-[1-[2-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[2-fluoro-4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide
CID 159241917

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide?
The IUPAC name of N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide (CID 161136595) is N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide.
What is the SMILES notation for N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide?
The canonical SMILES for N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide is CC(=O)NC(C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)c(F)c1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC(C)C)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4(F)F)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3)CC2)cc1.CC(=O)N[C@@H](C)c1ccc(N2CCC(c3ccc(OCC4CC4)cc3F)CC2)cc1.CCCOc1ccc(C2CCN(c3ccc(C(C)NC(C)=O)cc3F)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)c(C)c1.CCCOc1ccc(C2CCN(c3ccc([C@H](C)NC(C)=O)cc3)CC2)cc1.C[C@H](NC(=O)N(C)C)c1ccc(N2CCC(c3ccc(OC4CCC4)cc3)CC2)cc1.
What is the InChIKey of N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide?
The InChIKey is UMWNOSZZJXGEKA-CFQSYIPKSA-N. The full InChI is InChI=1S/C26H35N3O2.2C25H30F2N2O2.C25H31FN2O2.C25H33FN2O2.2C25H32N2O2.C25H34N2O2.2C24H32N2O2/c1-19(27-26(30)28(2)3)20-7-11-23(12-8-20)29-17-15-22(16-18-29)21-9-13-25(14-10-21)31-24-5-4-6-24;1-17(28-18(2)30)19-3-7-23(8-4-19)29-13-11-21(12-14-29)20-5-9-24(10-6-20)31-16-22-15-25(22,26)27;1-16(28-17(2)30)20-5-8-25(24(27)13-20)29-11-9-19(10-12-29)22-7-6-21(14-23(22)26)31-15-18-3-4-18;1-17(27-18(2)29)20-5-7-22(8-6-20)28-13-11-21(12-14-28)24-10-9-23(15-25(24)26)30-16-19-3-4-19;1-5-14-30-22-7-8-23(17(2)15-22)20-10-12-28(13-11-20)25-9-6-21(16-24(25)26)18(3)27-19(4)29;1-18(26-19(2)28)21-5-9-24(10-6-21)27-15-13-23(14-16-27)22-7-11-25(12-8-22)29-17-20-3-4-20;1-18(26-19(2)28)20-6-10-23(11-7-20)27-16-14-22(15-17-27)21-8-12-25(13-9-21)29-24-4-3-5-24;1-5-16-29-24-10-11-25(18(2)17-24)22-12-14-27(15-13-22)23-8-6-21(7-9-23)19(3)26-20(4)28;1-17(2)28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(3)25-19(4)27;1-4-17-28-24-11-7-21(8-12-24)22-13-15-26(16-14-22)23-9-5-20(6-10-23)18(2)25-19(3)27/h7-14,19,22,24H,4-6,15-18H2,1-3H3,(H,27,30);3-10,17,21-22H,11-16H2,1-2H3,(H,28,30);5-8,13-14,16,18-19H,3-4,9-12,15H2,1-2H3,(H,28,30);5-10,15,17,19,21H,3-4,11-14,16H2,1-2H3,(H,27,29);6-9,15-16,18,20H,5,10-14H2,1-4H3,(H,27,29);5-12,18,20,23H,3-4,13-17H2,1-2H3,(H,26,28);6-13,18,22,24H,3-5,14-17H2,1-2H3,(H,26,28);6-11,17,19,22H,5,12-16H2,1-4H3,(H,26,28);5-12,17-18,22H,13-16H2,1-4H3,(H,25,27);5-12,18,22H,4,13-17H2,1-3H3,(H,25,27)/t19-;17-,22?;;17-;;2*18-;19-;2*18-/m00.0.00000/s1.
What are the key properties of N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide?
N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide has a molecular weight of 4042.42 g/mol, XLogP of 52.40, 67 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;3-[(1S)-1-[4-[4-(4-cyclobutyloxyphenyl)piperidin-1-yl]phenyl]ethyl]-1,1-dimethylurea;N-[1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]-3-fluorophenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)-2-fluorophenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-(cyclopropylmethoxy)phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-[4-[(2,2-difluorocyclopropyl)methoxy]phenyl]piperidin-1-yl]phenyl]ethyl]acetamide;N-[1-[3-fluoro-4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(2-methyl-4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propan-2-yloxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide;N-[(1S)-1-[4-[4-(4-propoxyphenyl)piperidin-1-yl]phenyl]ethyl]acetamide is sourced from PubChem (CID 161136595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).