bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine

C187H388N20O13 — CID 160530032

IUPACbis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine
SMILESCC(C)(C)/C=C/CN1CCN(C(C)(C)C)CC1.CC(C)(C)C#CCN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCN(CCCCOC(C)(C)C)CC1.CC(C)(C)COCCOCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OCCCCN1CCC(C(C)(C)C)CC1.CC(C)(C)OCCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCOCCN1CCN(C(C)(C)C)CC1.CN(CCCCN1CCN(C(C)(C)C)CC1)C(C)(C)C
InChIInChI=1S/C17H37N3.C17H36N2O2.C17H36N2O.C17H35NO.C16H34N2O2.C16H34N2O.C15H32N2O.C15H30N2.C15H28N2.C14H30N2O.2C14H28O2/c1-16(2,3)18(7)10-8-9-11-19-12-14-20(15-13-19)17(4,5)6;1-16(2,3)15-21-14-13-20-12-11-18-7-9-19(10-8-18)17(4,5)6;1-16(2,3)15-19-12-10-18(11-13-19)9-7-8-14-20-17(4,5)6;1-16(2,3)15-9-12-18(13-10-15)11-7-8-14-19-17(4,5)6;1-15(2,3)18-9-7-17(8-10-18)11-12-19-13-14-20-16(4,5)6;1-15(2,3)18-12-10-17(11-13-18)9-7-8-14-19-16(4,5)6;1-14(2,3)17-11-9-16(10-12-17)8-7-13-18-15(4,5)6;2*1-14(2,3)8-7-9-16-10-12-17(13-11-16)15(4,5)6;1-13(2,3)16-9-7-15(8-10-16)11-12-17-14(4,5)6;2*1-13(2,3)15-11-7-9-12(10-8-11)16-14(4,5)6/h8-15H2,1-7H3;7-15H2,1-6H3;7-15H2,1-6H3;15H,7-14H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;7-13H2,1-6H3;7-8H,9-13H2,1-6H3;9-13H2,1-6H3;7-12H2,1-6H3;2*11-12H,7-10H2,1-6H3/b;;;;;;;8-7+;;;;
InChIKeyQVKMVGKHXJNEDM-PRLZQGKXSA-N
MW3125.29 g/mol
LogP36.35
Rot. Bonds48

About bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine

bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine (PubChem CID 160530032) has the molecular formula C187H388N20O13 and a molecular weight of 3125.29 g/mol. Its IUPAC name is bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine.

Molecular Properties

Compound Namebis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine
PubChem CID160530032
Molecular FormulaC187H388N20O13
Molecular Weight3125.29 g/mol
Exact Mass3123.03
IUPAC Namebis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine
SMILESCC(C)(C)/C=C/CN1CCN(C(C)(C)C)CC1.CC(C)(C)C#CCN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCN(CCCCOC(C)(C)C)CC1.CC(C)(C)COCCOCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OCCCCN1CCC(C(C)(C)C)CC1.CC(C)(C)OCCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCOCCN1CCN(C(C)(C)C)CC1.CN(CCCCN1CCN(C(C)(C)C)CC1)C(C)(C)C
InChIInChI=1S/C17H37N3.C17H36N2O2.C17H36N2O.C17H35NO.C16H34N2O2.C16H34N2O.C15H32N2O.C15H30N2.C15H28N2.C14H30N2O.2C14H28O2/c1-16(2,3)18(7)10-8-9-11-19-12-14-20(15-13-19)17(4,5)6;1-16(2,3)15-21-14-13-20-12-11-18-7-9-19(10-8-18)17(4,5)6;1-16(2,3)15-19-12-10-18(11-13-19)9-7-8-14-20-17(4,5)6;1-16(2,3)15-9-12-18(13-10-15)11-7-8-14-19-17(4,5)6;1-15(2,3)18-9-7-17(8-10-18)11-12-19-13-14-20-16(4,5)6;1-15(2,3)18-12-10-17(11-13-18)9-7-8-14-19-16(4,5)6;1-14(2,3)17-11-9-16(10-12-17)8-7-13-18-15(4,5)6;2*1-14(2,3)8-7-9-16-10-12-17(13-11-16)15(4,5)6;1-13(2,3)16-9-7-15(8-10-16)11-12-17-14(4,5)6;2*1-13(2,3)15-11-7-9-12(10-8-11)16-14(4,5)6/h8-15H2,1-7H3;7-15H2,1-6H3;7-15H2,1-6H3;15H,7-14H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;7-13H2,1-6H3;7-8H,9-13H2,1-6H3;9-13H2,1-6H3;7-12H2,1-6H3;2*11-12H,7-10H2,1-6H3/b;;;;;;;8-7+;;;;
InChIKeyQVKMVGKHXJNEDM-PRLZQGKXSA-N
XLogP36.35
TPSA184.79 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds48
Heavy Atoms220
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003125.29
LogP ≤ 536.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

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

Analyze bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine with MolForge

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Launch Full Analysis

Related Compounds

1-tert-butyl-4-(3,3-dimethylbutyl)piperazine;1-tert-butyl-4-(6,6-dimethylheptyl)piperazine;1-tert-butyl-4-[2-(5,5-dimethylhexoxy)ethyl]piperazine;1-tert-butyl-4-(5,5-dimethylhexyl)piperazine;1-tert-butyl-N-(7,7-dimethyloctyl)-N-methylpiperidin-4-amine;1-tert-butyl-4-[3-(4,4-dimethylpentoxy)propyl]piperazine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1,4-ditert-butylpiperazine
CID 159108032
1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine
CID 135167668
1-tert-butyl-4-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine
CID 171446821
1-tert-butyl-4-[2-[[1-(2,2-dimethylpropyl)piperidin-4-yl]methoxy]ethyl]piperazine
CID 146548352
1-tert-butyl-4-[(4-tert-butylpiperazin-1-yl)methyl]piperazine;1-tert-butyl-4-[(4-tert-butylpiperidin-1-yl)methyl]piperazine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;1-tert-butyl-4-(4,4-dimethylpentyl)piperidine;4-tert-butyl-1-(4,4-dimethylpentyl)piperidine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]methyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-(1-tert-butylpiperidin-4-yl)ethanol;1-[(1-tert-butylpiperidin-4-yl)methyl]piperazine;1-tert-butyl-4-propylpiperidine;tris(2-methylpropane)
CID 164988091
1-tert-butyl-4-[2-[2-(4,4-dimethylpentoxy)ethoxy]ethyl]piperazine
CID 139545698
1-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]-4-[5-[(2-methylpropan-2-yl)oxy]pentyl]piperazine
CID 134488979
1-(3-butoxypropyl)-4-tert-butylpiperazine;1-butyl-4-tert-butylpiperazine;1-tert-butyl-4-ethylpiperazine;4-tert-butyl-1-heptylpiperidine;4-tert-butyl-1-hexylpiperidine;4-tert-butyl-1-nonylpiperidine;4-tert-butyl-1-octylpiperidine;1-tert-butylpiperidine;1-tert-butyl-4-propylpiperazine;N-(7,7-dimethyloctyl)-N-methylcyclohexanamine;N,7,7-trimethyl-N-propyloctan-1-amine
CID 167660939
3-[(2-methylpropan-2-yl)oxy]-1-[2-[3-[(2-methylpropan-2-yl)oxy]propoxy]ethyl]azetidine
CID 134488874
1-tert-butyl-4-[2-(2-propoxyethoxy)ethyl]piperazine
CID 166875795
1-tert-butyl-4-[[1-[[4-(2,2-dimethylpropyl)phenyl]methyl]azetidin-3-yl]methyl]piperazine;6,6-dimethyl-1-[(2-methylpropan-2-yl)oxy]heptane;6,6-dimethyl-1-[3-[(2-methylpropan-2-yl)oxy]propoxy]heptane;2,2-dimethyl-1-[3-[(2-methylpropan-2-yl)oxy]propoxy]propane;6,6-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]heptane;5,5-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]hexane;2,2-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propane;6,6-dimethyl-1-[3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propoxy]heptane;2,2-dimethyl-1-[3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propoxy]propane;2,2-dimethyl-1-[3-[3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]propoxy]propoxy]propane;3-[3-(2,2-dimethylpropoxy)propoxy]-N-methyl-N-[3-[(2-methylpropan-2-yl)oxy]propyl]propan-1-amine;1-(2,2-dimethylpropyl)-3-[[4-(2,2-dimethylpropyl)phenyl]methoxymethyl]azetidine;1-(2,2-dimethylpropyl)-3-[[4-(2,2-dimethylpropyl)phenyl]methoxymethyl]pyrrolidine;1-(2,2-dimethylpropyl)-3-[[4-(2,2-dimethylpropyl)phenyl]methyl]azetidine
CID 157482386
3,3-dimethyl-1-[2-[2-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]ethoxy]ethoxy]butan-2-one
CID 169289811

Frequently Asked Questions

What is the IUPAC name of bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine?
The IUPAC name of bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine (CID 160530032) is bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine.
What is the SMILES notation for bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine?
The canonical SMILES for bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine is CC(C)(C)/C=C/CN1CCN(C(C)(C)C)CC1.CC(C)(C)C#CCN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCN(CCCCOC(C)(C)C)CC1.CC(C)(C)COCCOCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OC1CCC(OC(C)(C)C)CC1.CC(C)(C)OCCCCN1CCC(C(C)(C)C)CC1.CC(C)(C)OCCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCN1CCN(C(C)(C)C)CC1.CC(C)(C)OCCOCCN1CCN(C(C)(C)C)CC1.CN(CCCCN1CCN(C(C)(C)C)CC1)C(C)(C)C.
What is the InChIKey of bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine?
The InChIKey is QVKMVGKHXJNEDM-PRLZQGKXSA-N. The full InChI is InChI=1S/C17H37N3.C17H36N2O2.C17H36N2O.C17H35NO.C16H34N2O2.C16H34N2O.C15H32N2O.C15H30N2.C15H28N2.C14H30N2O.2C14H28O2/c1-16(2,3)18(7)10-8-9-11-19-12-14-20(15-13-19)17(4,5)6;1-16(2,3)15-21-14-13-20-12-11-18-7-9-19(10-8-18)17(4,5)6;1-16(2,3)15-19-12-10-18(11-13-19)9-7-8-14-20-17(4,5)6;1-16(2,3)15-9-12-18(13-10-15)11-7-8-14-19-17(4,5)6;1-15(2,3)18-9-7-17(8-10-18)11-12-19-13-14-20-16(4,5)6;1-15(2,3)18-12-10-17(11-13-18)9-7-8-14-19-16(4,5)6;1-14(2,3)17-11-9-16(10-12-17)8-7-13-18-15(4,5)6;2*1-14(2,3)8-7-9-16-10-12-17(13-11-16)15(4,5)6;1-13(2,3)16-9-7-15(8-10-16)11-12-17-14(4,5)6;2*1-13(2,3)15-11-7-9-12(10-8-11)16-14(4,5)6/h8-15H2,1-7H3;7-15H2,1-6H3;7-15H2,1-6H3;15H,7-14H2,1-6H3;7-14H2,1-6H3;7-14H2,1-6H3;7-13H2,1-6H3;7-8H,9-13H2,1-6H3;9-13H2,1-6H3;7-12H2,1-6H3;2*11-12H,7-10H2,1-6H3/b;;;;;;;8-7+;;;;.
What are the key properties of bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine?
bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine has a molecular weight of 3125.29 g/mol, XLogP of 36.35, 48 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,4-bis[(2-methylpropan-2-yl)oxy]cyclohexane);N-tert-butyl-4-(4-tert-butylpiperazin-1-yl)-N-methylbutan-1-amine;1-tert-butyl-4-[(E)-4,4-dimethylpent-2-enyl]piperazine;1-tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethyl]piperazine;1-tert-butyl-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine;4-tert-butyl-1-[4-[(2-methylpropan-2-yl)oxy]butyl]piperidine;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;1-(2,2-dimethylpropyl)-4-[4-[(2-methylpropan-2-yl)oxy]butyl]piperazine is sourced from PubChem (CID 160530032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).