2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane

C173H341N17 — CID 164992203

IUPAC2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
SMILESCC(C)(C)C1CC2CCC1CC2C(C)(C)C.CC(C)(C)C1CC2CCC1CN2C(C)(C)C.CC(C)(C)C1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)C1CCC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CCN(C(C)(C)C)C2)C1.CC(C)(C)N1CCCC2(CCN(C(C)(C)C)C2)C1
InChIInChI=1S/C18H35N.C17H34N2.C17H33N.2C16H32N2.C16H30.3C15H30N2.C15H29N.C13H26N2/c1-16(2,3)15-7-9-18(10-8-15)11-13-19(14-12-18)17(4,5)6;1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)14-7-8-17(13-14)9-11-18(12-10-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-14(2,3)17-10-7-8-16(12-17)9-11-18(13-16)15(4,5)6;1-15(2,3)13-9-12-8-7-11(13)10-14(12)16(4,5)6;1-13(2,3)16-9-7-15(11-16)8-10-17(12-15)14(4,5)6;2*1-13(2,3)16-9-7-15(8-10-16)11-17(12-15)14(4,5)6;1-14(2,3)13-9-12-8-7-11(13)10-16(12)15(4,5)6;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h15H,7-14H2,1-6H3;7-14H2,1-6H3;14H,7-13H2,1-6H3;2*7-13H2,1-6H3;11-14H,7-10H2,1-6H3;3*7-12H2,1-6H3;11-13H,7-10H2,1-6H3;7-10H2,1-6H3
InChIKeyHABMTBUAOQDISG-UHFFFAOYSA-N
MW2659.75 g/mol
LogP40.53
Rot. Bonds

About 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane

2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane (PubChem CID 164992203) has the molecular formula C173H341N17 and a molecular weight of 2659.75 g/mol. Its IUPAC name is 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
PubChem CID164992203
Molecular FormulaC173H341N17
Molecular Weight2659.75 g/mol
Exact Mass2657.72
IUPAC Name2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
SMILESCC(C)(C)C1CC2CCC1CC2C(C)(C)C.CC(C)(C)C1CC2CCC1CN2C(C)(C)C.CC(C)(C)C1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)C1CCC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CCN(C(C)(C)C)C2)C1.CC(C)(C)N1CCCC2(CCN(C(C)(C)C)C2)C1
InChIInChI=1S/C18H35N.C17H34N2.C17H33N.2C16H32N2.C16H30.3C15H30N2.C15H29N.C13H26N2/c1-16(2,3)15-7-9-18(10-8-15)11-13-19(14-12-18)17(4,5)6;1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)14-7-8-17(13-14)9-11-18(12-10-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-14(2,3)17-10-7-8-16(12-17)9-11-18(13-16)15(4,5)6;1-15(2,3)13-9-12-8-7-11(13)10-14(12)16(4,5)6;1-13(2,3)16-9-7-15(11-16)8-10-17(12-15)14(4,5)6;2*1-13(2,3)16-9-7-15(8-10-16)11-17(12-15)14(4,5)6;1-14(2,3)13-9-12-8-7-11(13)10-16(12)15(4,5)6;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h15H,7-14H2,1-6H3;7-14H2,1-6H3;14H,7-13H2,1-6H3;2*7-13H2,1-6H3;11-14H,7-10H2,1-6H3;3*7-12H2,1-6H3;11-13H,7-10H2,1-6H3;7-10H2,1-6H3
InChIKeyHABMTBUAOQDISG-UHFFFAOYSA-N
XLogP40.53
TPSA55.08 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds
Heavy Atoms190
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002659.75
LogP ≤ 540.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane with MolForge

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Related Compounds

2,6-dimethylheptane;2,5-dimethylhexane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;2-(2-methylpropyl)-1-propan-2-ylpiperidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;2-(2-methylpropyl)-1-propan-2-ylpyrrolidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
CID 157509307
2,7-Di(propan-2-yl)-2-azaspiro[4.5]decane;2,8-di(propan-2-yl)-2-azaspiro[4.5]decane;3,7-di(propan-2-yl)-7-azaspiro[4.5]decane;3,8-di(propan-2-yl)-8-azaspiro[4.5]decane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;2,6-di(propan-2-yl)-2-azaspiro[3.5]nonane;2,6-di(propan-2-yl)-6-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane);2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane;2,8-di(propan-2-yl)-2-azaspiro[4.4]nonane;bis(2,6-di(propan-2-yl)-2-azaspiro[3.4]octane);2,6-di(propan-2-yl)-6-azaspiro[3.4]octane
CID 158121825
CID 159426108
CID 159426108
3-Butyl-1-methylpiperidin-3-ide;4-butyl-1-methylpiperidin-4-ide;3-butyl-1-methylpyrrolidin-3-ide;2,2-di(ethyl)-1-methylpiperidine;3,3-di(ethyl)-1-methylpiperidine;4,4-di(ethyl)-1-methylpiperidine;2,2-di(ethyl)-1-methylpyrrolidine;3,3-di(ethyl)-1-methylpyrrolidine;1,9-dimethyl-1-azaspiro[5.5]undecane;1,10-dimethyl-1-azaspiro[5.5]undecane;2,9-dimethyl-2-azaspiro[5.5]undecane;2,11-dimethyl-2-azaspiro[5.5]undecane;3,9-dimethyl-3-azaspiro[5.5]undecane;3,10-dimethyl-3-azaspiro[5.5]undecane;2-methanidyl-1-methyl-2-propylpiperidine;3-methanidyl-1-methyl-3-propylpiperidine;4-methanidyl-1-methyl-4-propylpiperidine;2-methanidyl-1-methyl-2-propylpyrrolidine;3-methanidyl-1-methyl-3-propylpyrrolidine;tridecakis(yttrium)
CID 159539934
2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;1,3-di(propan-2-yl)azetidine;tetrakis(1,3-di(propan-2-yl)cyclobutane);bis(1,4-di(propan-2-yl)cyclohexane);1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;bis(1,3-di(propan-2-yl)pyrrolidine);bis(2-(2-methylpropyl)-1-propan-2-ylazetidine);(2R)-2-(2-methylpropyl)-1-propan-2-ylazetidine;3-(2-methylpropyl)-1-propan-2-ylazetidine;2-(2-methylpropyl)-1-propan-2-ylpiperidine;bis(3-(2-methylpropyl)-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-propan-2-ylpiperidine;2-(2-methylpropyl)-1-propan-2-ylpyrrolidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
CID 159644958
CID 160335784
CID 160335784
2,7-Di(propan-2-yl)-2-azaspiro[4.5]decane;2,8-di(propan-2-yl)-2-azaspiro[4.5]decane;3,7-di(propan-2-yl)-7-azaspiro[4.5]decane;3,8-di(propan-2-yl)-8-azaspiro[4.5]decane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;2,6-di(propan-2-yl)-2-azaspiro[3.5]nonane;2,6-di(propan-2-yl)-6-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane);2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane;2,8-di(propan-2-yl)-2-azaspiro[4.4]nonane;bis(2,6-di(propan-2-yl)-2-azaspiro[3.4]octane);2,6-di(propan-2-yl)-6-azaspiro[3.4]octane;2,9-di(propan-2-yl)-2-azaspiro[5.5]undecane;3,9-di(propan-2-yl)-3-azaspiro[5.5]undecane
CID 160480564
2,7-Di(propan-2-yl)-2-azaspiro[4.5]decane;2,8-di(propan-2-yl)-2-azaspiro[4.5]decane;3,7-di(propan-2-yl)-7-azaspiro[4.5]decane;3,8-di(propan-2-yl)-8-azaspiro[4.5]decane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;2,6-di(propan-2-yl)-2-azaspiro[3.5]nonane;2,6-di(propan-2-yl)-6-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane);2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane;2,8-di(propan-2-yl)-2-azaspiro[4.4]nonane;bis(2,6-di(propan-2-yl)-2-azaspiro[3.4]octane);2,6-di(propan-2-yl)-6-azaspiro[3.4]octane;2,9-di(propan-2-yl)-2-azaspiro[5.5]undecane;2,10-di(propan-2-yl)-2-azaspiro[5.5]undecane;3,9-di(propan-2-yl)-3-azaspiro[5.5]undecane;3,10-di(propan-2-yl)-3-azaspiro[5.5]undecane;methane
CID 162028729
2,5-di(propan-2-yl)-2-azabicyclo[2.2.1]heptane;(6S)-2,6-di(propan-2-yl)-2-azabicyclo[2.2.1]heptane;(6S)-2,6-di(propan-2-yl)-2-azabicyclo[2.2.2]octane;(7R)-2,7-di(propan-2-yl)-2-azaspiro[4.5]decane;2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane;2,9-di(propan-2-yl)-2-azaspiro[5.5]undecane;1,3-di(propan-2-yl)azetidine;(2S)-1,2-di(propan-2-yl)azetidine;(1R)-1,3-di(propan-2-yl)cyclohexane;2,9-di(propan-2-yl)-2,9-diazaspiro[4.5]decane;1,4-di(propan-2-yl)piperidine;(2S)-1,2-di(propan-2-yl)piperidine;(3S)-1,3-di(propan-2-yl)piperidine;(2S)-1,2-di(propan-2-yl)pyrrolidine;(3S)-1,3-di(propan-2-yl)pyrrolidine;(3S)-3-(2-methylpropyl)-1-propan-2-ylpiperidine
CID 162157713
2,8-Ditert-butyl-2-azaspiro[4.5]decane;3,8-ditert-butyl-8-azaspiro[4.5]decane;2,7-ditert-butyl-2-azaspiro[3.5]nonane;2,7-ditert-butyl-7-azaspiro[3.5]nonane;2,8-ditert-butyl-2-azaspiro[4.4]nonane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane;2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane;3,8-ditert-butylspiro[4.5]decane;3,8-ditert-butylspiro[4.4]nonane;3,9-ditert-butylspiro[5.5]undecane
CID 163802893
3,8-Ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
CID 165000595
Bis(2,5-ditert-butyl-2-azabicyclo[2.2.2]octane);3,8-ditert-butyl-3-azabicyclo[3.2.1]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,5-ditert-butyl-2,5-diazabicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane;1,3-ditert-butylimidazolidine
CID 165001472

Frequently Asked Questions

What is the IUPAC name of 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The IUPAC name of 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane (CID 164992203) is 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The canonical SMILES for 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane is CC(C)(C)C1CC2CCC1CC2C(C)(C)C.CC(C)(C)C1CC2CCC1CN2C(C)(C)C.CC(C)(C)C1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)C1CCC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)N1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CCN(C(C)(C)C)CC2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)N1CCC2(CCN(C(C)(C)C)C2)C1.CC(C)(C)N1CCCC2(CCN(C(C)(C)C)C2)C1.
What is the InChIKey of 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
The InChIKey is HABMTBUAOQDISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N.C17H34N2.C17H33N.2C16H32N2.C16H30.3C15H30N2.C15H29N.C13H26N2/c1-16(2,3)15-7-9-18(10-8-15)11-13-19(14-12-18)17(4,5)6;1-15(2,3)18-11-7-17(8-12-18)9-13-19(14-10-17)16(4,5)6;1-15(2,3)14-7-8-17(13-14)9-11-18(12-10-17)16(4,5)6;1-14(2,3)17-10-7-16(8-11-17)9-12-18(13-16)15(4,5)6;1-14(2,3)17-10-7-8-16(12-17)9-11-18(13-16)15(4,5)6;1-15(2,3)13-9-12-8-7-11(13)10-14(12)16(4,5)6;1-13(2,3)16-9-7-15(11-16)8-10-17(12-15)14(4,5)6;2*1-13(2,3)16-9-7-15(8-10-16)11-17(12-15)14(4,5)6;1-14(2,3)13-9-12-8-7-11(13)10-16(12)15(4,5)6;1-11(2,3)14-7-13(8-14)9-15(10-13)12(4,5)6/h15H,7-14H2,1-6H3;7-14H2,1-6H3;14H,7-13H2,1-6H3;2*7-13H2,1-6H3;11-14H,7-10H2,1-6H3;3*7-12H2,1-6H3;11-13H,7-10H2,1-6H3;7-10H2,1-6H3.
What are the key properties of 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane?
2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane has a molecular weight of 2659.75 g/mol, XLogP of 40.53, 0 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-ditert-butyl-2-azabicyclo[2.2.2]octane;3,8-ditert-butyl-8-azaspiro[4.5]decane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,5-ditert-butylbicyclo[2.2.2]octane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,9-ditert-butyl-2,9-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;bis(2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane);2,7-ditert-butyl-2,7-diazaspiro[4.4]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 164992203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).