1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane

C236H478N26O27 — CID 159357837

IUPAC1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane
SMILESCC(C)(C)CCC(=O)N1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC(=O)CN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)NCCN1CCN(C(C)(C)C)CC1.CC(C)(C)NCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)OC1CC(OCCCOCCCOC2CN(C(C)(C)C)C2)C1.CC(C)(C)OC1CCC(OCCN2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCCCOC1CC2(C1)CN(C(=O)C1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCCOC1CC2(C1)CN(CC1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCOCCCCCOC1CC(OC(C)(C)C)C1.CC(COC(C)(C)C)N1CCN(CC(=O)NCC(C)(C)C)CC1
InChIInChI=1S/C23H41NO4.C23H43NO3.C21H41NO4.C20H40N2O2.C20H40O4.C18H37N3O2.C17H35N3O2.C17H37N3O.C17H34N2O2.C16H35N3O.2C15H32N2O.C14H31N3/c1-21(2,3)27-10-8-7-9-26-19-13-23(14-19)15-24(16-23)20(25)17-11-18(12-17)28-22(4,5)6;1-21(2,3)26-10-8-7-9-25-20-13-23(14-20)16-24(17-23)15-18-11-19(12-18)27-22(4,5)6;1-20(2,3)22-15-19(16-22)25-12-8-10-23-9-7-11-24-17-13-18(14-17)26-21(4,5)6;1-19(2,3)22-13-11-21(12-14-22)15-16-23-17-7-9-18(10-8-17)24-20(4,5)6;1-19(2,3)23-14-10-12-21-11-8-7-9-13-22-17-15-18(16-17)24-20(4,5)6;1-15(13-23-18(5,6)7)21-10-8-20(9-11-21)12-16(22)19-14-17(2,3)4;1-16(2,3)14-18-15(21)13-20-9-7-19(8-10-20)11-12-22-17(4,5)6;1-16(2,3)18-8-7-9-19-10-12-20(13-11-19)14-15-21-17(4,5)6;1-16(2,3)8-7-15(20)19-11-9-18(10-12-19)13-14-21-17(4,5)6;1-15(2,3)17-7-8-18-9-11-19(12-10-18)13-14-20-16(4,5)6;1-14(2,3)11-16-13-7-9-17(10-8-13)12-18-15(4,5)6;1-14(2,3)16-11-13-7-9-17(10-8-13)12-18-15(4,5)6;1-13(2,3)15-7-8-16-9-11-17(12-10-16)14(4,5)6/h17-19H,7-16H2,1-6H3;18-20H,7-17H2,1-6H3;17-19H,7-16H2,1-6H3;2*17-18H,7-16H2,1-6H3;15H,8-14H2,1-7H3,(H,19,22);7-14H2,1-6H3,(H,18,21);18H,7-15H2,1-6H3;7-14H2,1-6H3;17H,7-14H2,1-6H3;2*13,16H,7-12H2,1-6H3;15H,7-12H2,1-6H3
InChIKeyLIDODQIRUMLBBN-UHFFFAOYSA-N
MW4112.57 g/mol
LogP38.61
Rot. Bonds86

About 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane

1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane (PubChem CID 159357837) has the molecular formula C236H478N26O27 and a molecular weight of 4112.57 g/mol. Its IUPAC name is 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane.

Molecular Properties

Compound Name1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane
PubChem CID159357837
Molecular FormulaC236H478N26O27
Molecular Weight4112.57 g/mol
Exact Mass4109.68
IUPAC Name1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane
SMILESCC(C)(C)CCC(=O)N1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC(=O)CN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)NCCN1CCN(C(C)(C)C)CC1.CC(C)(C)NCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)OC1CC(OCCCOCCCOC2CN(C(C)(C)C)C2)C1.CC(C)(C)OC1CCC(OCCN2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCCCOC1CC2(C1)CN(C(=O)C1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCCOC1CC2(C1)CN(CC1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCOCCCCCOC1CC(OC(C)(C)C)C1.CC(COC(C)(C)C)N1CCN(CC(=O)NCC(C)(C)C)CC1
InChIInChI=1S/C23H41NO4.C23H43NO3.C21H41NO4.C20H40N2O2.C20H40O4.C18H37N3O2.C17H35N3O2.C17H37N3O.C17H34N2O2.C16H35N3O.2C15H32N2O.C14H31N3/c1-21(2,3)27-10-8-7-9-26-19-13-23(14-19)15-24(16-23)20(25)17-11-18(12-17)28-22(4,5)6;1-21(2,3)26-10-8-7-9-25-20-13-23(14-20)16-24(17-23)15-18-11-19(12-18)27-22(4,5)6;1-20(2,3)22-15-19(16-22)25-12-8-10-23-9-7-11-24-17-13-18(14-17)26-21(4,5)6;1-19(2,3)22-13-11-21(12-14-22)15-16-23-17-7-9-18(10-8-17)24-20(4,5)6;1-19(2,3)23-14-10-12-21-11-8-7-9-13-22-17-15-18(16-17)24-20(4,5)6;1-15(13-23-18(5,6)7)21-10-8-20(9-11-21)12-16(22)19-14-17(2,3)4;1-16(2,3)14-18-15(21)13-20-9-7-19(8-10-20)11-12-22-17(4,5)6;1-16(2,3)18-8-7-9-19-10-12-20(13-11-19)14-15-21-17(4,5)6;1-16(2,3)8-7-15(20)19-11-9-18(10-12-19)13-14-21-17(4,5)6;1-15(2,3)17-7-8-18-9-11-19(12-10-18)13-14-20-16(4,5)6;1-14(2,3)11-16-13-7-9-17(10-8-13)12-18-15(4,5)6;1-14(2,3)16-11-13-7-9-17(10-8-13)12-18-15(4,5)6;1-13(2,3)15-7-8-16-9-11-17(12-10-16)14(4,5)6/h17-19H,7-16H2,1-6H3;18-20H,7-17H2,1-6H3;17-19H,7-16H2,1-6H3;2*17-18H,7-16H2,1-6H3;15H,8-14H2,1-7H3,(H,19,22);7-14H2,1-6H3,(H,18,21);18H,7-15H2,1-6H3;7-14H2,1-6H3;17H,7-14H2,1-6H3;2*13,16H,7-12H2,1-6H3;15H,7-12H2,1-6H3
InChIKeyLIDODQIRUMLBBN-UHFFFAOYSA-N
XLogP38.61
TPSA426.34 Ų
H-Bond Donors7
H-Bond Acceptors49
Rotatable Bonds86
Heavy Atoms289
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004112.57
LogP ≤ 538.61
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1049

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane?
The IUPAC name of 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane (CID 159357837) is 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane.
What is the SMILES notation for 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane?
The canonical SMILES for 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane is CC(C)(C)CCC(=O)N1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC(=O)CN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CNC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCC1CCN(COC(C)(C)C)CC1.CC(C)(C)NCCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)NCCN1CCN(C(C)(C)C)CC1.CC(C)(C)NCCN1CCN(CCOC(C)(C)C)CC1.CC(C)(C)OC1CC(OCCCOCCCOC2CN(C(C)(C)C)C2)C1.CC(C)(C)OC1CCC(OCCN2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCCCOC1CC2(C1)CN(C(=O)C1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCCOC1CC2(C1)CN(CC1CC(OC(C)(C)C)C1)C2.CC(C)(C)OCCCOCCCCCOC1CC(OC(C)(C)C)C1.CC(COC(C)(C)C)N1CCN(CC(=O)NCC(C)(C)C)CC1.
What is the InChIKey of 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane?
The InChIKey is LIDODQIRUMLBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H41NO4.C23H43NO3.C21H41NO4.C20H40N2O2.C20H40O4.C18H37N3O2.C17H35N3O2.C17H37N3O.C17H34N2O2.C16H35N3O.2C15H32N2O.C14H31N3/c1-21(2,3)27-10-8-7-9-26-19-13-23(14-19)15-24(16-23)20(25)17-11-18(12-17)28-22(4,5)6;1-21(2,3)26-10-8-7-9-25-20-13-23(14-20)16-24(17-23)15-18-11-19(12-18)27-22(4,5)6;1-20(2,3)22-15-19(16-22)25-12-8-10-23-9-7-11-24-17-13-18(14-17)26-21(4,5)6;1-19(2,3)22-13-11-21(12-14-22)15-16-23-17-7-9-18(10-8-17)24-20(4,5)6;1-19(2,3)23-14-10-12-21-11-8-7-9-13-22-17-15-18(16-17)24-20(4,5)6;1-15(13-23-18(5,6)7)21-10-8-20(9-11-21)12-16(22)19-14-17(2,3)4;1-16(2,3)14-18-15(21)13-20-9-7-19(8-10-20)11-12-22-17(4,5)6;1-16(2,3)18-8-7-9-19-10-12-20(13-11-19)14-15-21-17(4,5)6;1-16(2,3)8-7-15(20)19-11-9-18(10-12-19)13-14-21-17(4,5)6;1-15(2,3)17-7-8-18-9-11-19(12-10-18)13-14-20-16(4,5)6;1-14(2,3)11-16-13-7-9-17(10-8-13)12-18-15(4,5)6;1-14(2,3)16-11-13-7-9-17(10-8-13)12-18-15(4,5)6;1-13(2,3)15-7-8-16-9-11-17(12-10-16)14(4,5)6/h17-19H,7-16H2,1-6H3;18-20H,7-17H2,1-6H3;17-19H,7-16H2,1-6H3;2*17-18H,7-16H2,1-6H3;15H,8-14H2,1-7H3,(H,19,22);7-14H2,1-6H3,(H,18,21);18H,7-15H2,1-6H3;7-14H2,1-6H3;17H,7-14H2,1-6H3;2*13,16H,7-12H2,1-6H3;15H,7-12H2,1-6H3.
What are the key properties of 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane?
1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane has a molecular weight of 4112.57 g/mol, XLogP of 38.61, 86 rotatable bonds, 7 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypropoxy]propoxy]azetidine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine;[6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-azaspiro[3.3]heptan-2-yl]-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methanone;6-[4-[(2-methylpropan-2-yl)oxy]butoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]methyl]-2-azaspiro[3.3]heptane;1-[(2-methylpropan-2-yl)oxy]-3-[5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pentoxy]cyclobutane is sourced from PubChem (CID 159357837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).