azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine

C283H567N25 — CID 164948821

IUPACazane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine
SMILESCC(C)(C)C1C2CN(C(C)(C)C)CC21.CC(C)(C)C1CCC2(CC2)N(C(C)(C)C)C1.CC(C)(C)C1CCCCN1C(C)(C)C.CC(C)(C)C1CCCN(C(C)(C)C)C1.CC(C)(C)C1CCCN1C(C)(C)C.CC(C)(C)C1CCN(C(C)(C)C)C1.CC(C)(C)C1CCN(C(C)(C)C)C2(CC2)C1.CC(C)(C)C1CCN(C(C)(C)C)C2CC21.CC(C)(C)C1CCN(C(C)(C)C)CC1.CC(C)(C)C1CCN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)C1.CC(C)(C)C1CN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)CC2(CC2)C1.CC(C)(C)C1CN(C(C)(C)C)CC2CC21.CC(C)(C)C1CN(C(C)(C)C)CCC12CC2.CC(C)(C)N1CC2CC1CN2C(C)(C)C.CC(C)(C)N1CC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCC2(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCCN(C(C)(C)C)CC1.CC(C)(C)N1CCN(C(C)(C)C)CC1.N
InChIInChI=1S/5C15H29N.5C14H27N.C13H26N2.C13H28N2.2C13H25N.3C13H27N.C12H26N2.2C12H25N.C11H23N.H3N/c1-13(2,3)12-7-10-16(14(4,5)6)11-15(12)8-9-15;1-13(2,3)12-7-10-16(14(4,5)6)15(11-12)8-9-15;1-13(2,3)12-9-15(7-8-15)11-16(10-12)14(4,5)6;1-13(2,3)12-11-16(14(4,5)6)10-9-15(12)7-8-15;1-13(2,3)12-7-8-15(9-10-15)16(11-12)14(4,5)6;1-13(2,3)12-9-15(14(4,5)6)8-10-7-11(10)12;1-12(2,3)11-9-15(13(4,5)6)10-14(11)7-8-14;1-12(2,3)14-7-8-15(13(4,5)6)10-11(14)9-14;1-12(2,3)14-9-11(14)7-8-15(10-14)13(4,5)6;1-13(2,3)11-7-8-15(14(4,5)6)12-9-10(11)12;1-12(2,3)14-8-11-7-10(14)9-15(11)13(4,5)6;1-12(2,3)14-8-7-9-15(11-10-14)13(4,5)6;1-11(2,3)13-7-10(13)8-14(9-13)12(4,5)6;1-12(2,3)11-9-7-14(8-10(9)11)13(4,5)6;1-12(2,3)11-7-9-14(10-8-11)13(4,5)6;1-12(2,3)11-8-7-9-14(10-11)13(4,5)6;1-12(2,3)11-9-7-8-10-14(11)13(4,5)6;1-11(2,3)13-7-9-14(10-8-13)12(4,5)6;1-11(2,3)10-7-8-13(9-10)12(4,5)6;1-11(2,3)10-8-7-9-13(10)12(4,5)6;1-10(2,3)9-7-12(8-9)11(4,5)6;/h5*12H,7-11H2,1-6H3;10-12H,7-9H2,1-6H3;3*11H,7-10H2,1-6H3;10-12H,7-9H2,1-6H3;10-11H,7-9H2,1-6H3;7-11H2,1-6H3;10H,7-9H2,1-6H3;9-11H,7-8H2,1-6H3;3*11H,7-10H2,1-6H3;7-10H2,1-6H3;2*10H,7-9H2,1-6H3;9H,7-8H2,1-6H3;1H3
InChIKeyGADIBENTVJEFNX-UHFFFAOYSA-N
MW4320.82 g/mol
LogP70.96
Rot. Bonds

About azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine

azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine (PubChem CID 164948821) has the molecular formula C283H567N25 and a molecular weight of 4320.82 g/mol. Its IUPAC name is azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine.

Molecular Properties

Compound Nameazane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine
PubChem CID164948821
Molecular FormulaC283H567N25
Molecular Weight4320.82 g/mol
Exact Mass4317.51
IUPAC Nameazane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine
SMILESCC(C)(C)C1C2CN(C(C)(C)C)CC21.CC(C)(C)C1CCC2(CC2)N(C(C)(C)C)C1.CC(C)(C)C1CCCCN1C(C)(C)C.CC(C)(C)C1CCCN(C(C)(C)C)C1.CC(C)(C)C1CCCN1C(C)(C)C.CC(C)(C)C1CCN(C(C)(C)C)C1.CC(C)(C)C1CCN(C(C)(C)C)C2(CC2)C1.CC(C)(C)C1CCN(C(C)(C)C)C2CC21.CC(C)(C)C1CCN(C(C)(C)C)CC1.CC(C)(C)C1CCN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)C1.CC(C)(C)C1CN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)CC2(CC2)C1.CC(C)(C)C1CN(C(C)(C)C)CC2CC21.CC(C)(C)C1CN(C(C)(C)C)CCC12CC2.CC(C)(C)N1CC2CC1CN2C(C)(C)C.CC(C)(C)N1CC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCC2(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCCN(C(C)(C)C)CC1.CC(C)(C)N1CCN(C(C)(C)C)CC1.N
InChIInChI=1S/5C15H29N.5C14H27N.C13H26N2.C13H28N2.2C13H25N.3C13H27N.C12H26N2.2C12H25N.C11H23N.H3N/c1-13(2,3)12-7-10-16(14(4,5)6)11-15(12)8-9-15;1-13(2,3)12-7-10-16(14(4,5)6)15(11-12)8-9-15;1-13(2,3)12-9-15(7-8-15)11-16(10-12)14(4,5)6;1-13(2,3)12-11-16(14(4,5)6)10-9-15(12)7-8-15;1-13(2,3)12-7-8-15(9-10-15)16(11-12)14(4,5)6;1-13(2,3)12-9-15(14(4,5)6)8-10-7-11(10)12;1-12(2,3)11-9-15(13(4,5)6)10-14(11)7-8-14;1-12(2,3)14-7-8-15(13(4,5)6)10-11(14)9-14;1-12(2,3)14-9-11(14)7-8-15(10-14)13(4,5)6;1-13(2,3)11-7-8-15(14(4,5)6)12-9-10(11)12;1-12(2,3)14-8-11-7-10(14)9-15(11)13(4,5)6;1-12(2,3)14-8-7-9-15(11-10-14)13(4,5)6;1-11(2,3)13-7-10(13)8-14(9-13)12(4,5)6;1-12(2,3)11-9-7-14(8-10(9)11)13(4,5)6;1-12(2,3)11-7-9-14(10-8-11)13(4,5)6;1-12(2,3)11-8-7-9-14(10-11)13(4,5)6;1-12(2,3)11-9-7-8-10-14(11)13(4,5)6;1-11(2,3)13-7-9-14(10-8-13)12(4,5)6;1-11(2,3)10-7-8-13(9-10)12(4,5)6;1-11(2,3)10-8-7-9-13(10)12(4,5)6;1-10(2,3)9-7-12(8-9)11(4,5)6;/h5*12H,7-11H2,1-6H3;10-12H,7-9H2,1-6H3;3*11H,7-10H2,1-6H3;10-12H,7-9H2,1-6H3;10-11H,7-9H2,1-6H3;7-11H2,1-6H3;10H,7-9H2,1-6H3;9-11H,7-8H2,1-6H3;3*11H,7-10H2,1-6H3;7-10H2,1-6H3;2*10H,7-9H2,1-6H3;9H,7-8H2,1-6H3;1H3
InChIKeyGADIBENTVJEFNX-UHFFFAOYSA-N
XLogP70.96
TPSA112.76 Ų
H-Bond Donors1
H-Bond Acceptors25
Rotatable Bonds
Heavy Atoms308
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004320.82
LogP ≤ 570.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1025

Analyze azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine?
The IUPAC name of azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine (CID 164948821) is azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine.
What is the SMILES notation for azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine?
The canonical SMILES for azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine is CC(C)(C)C1C2CN(C(C)(C)C)CC21.CC(C)(C)C1CCC2(CC2)N(C(C)(C)C)C1.CC(C)(C)C1CCCCN1C(C)(C)C.CC(C)(C)C1CCCN(C(C)(C)C)C1.CC(C)(C)C1CCCN1C(C)(C)C.CC(C)(C)C1CCN(C(C)(C)C)C1.CC(C)(C)C1CCN(C(C)(C)C)C2(CC2)C1.CC(C)(C)C1CCN(C(C)(C)C)C2CC21.CC(C)(C)C1CCN(C(C)(C)C)CC1.CC(C)(C)C1CCN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)C1.CC(C)(C)C1CN(C(C)(C)C)CC12CC2.CC(C)(C)C1CN(C(C)(C)C)CC2(CC2)C1.CC(C)(C)C1CN(C(C)(C)C)CC2CC21.CC(C)(C)C1CN(C(C)(C)C)CCC12CC2.CC(C)(C)N1CC2CC1CN2C(C)(C)C.CC(C)(C)N1CC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCC2(C(C)(C)C)CC2C1.CC(C)(C)N1CCC2CC2(C(C)(C)C)C1.CC(C)(C)N1CCCN(C(C)(C)C)CC1.CC(C)(C)N1CCN(C(C)(C)C)CC1.N.
What is the InChIKey of azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine?
The InChIKey is GADIBENTVJEFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/5C15H29N.5C14H27N.C13H26N2.C13H28N2.2C13H25N.3C13H27N.C12H26N2.2C12H25N.C11H23N.H3N/c1-13(2,3)12-7-10-16(14(4,5)6)11-15(12)8-9-15;1-13(2,3)12-7-10-16(14(4,5)6)15(11-12)8-9-15;1-13(2,3)12-9-15(7-8-15)11-16(10-12)14(4,5)6;1-13(2,3)12-11-16(14(4,5)6)10-9-15(12)7-8-15;1-13(2,3)12-7-8-15(9-10-15)16(11-12)14(4,5)6;1-13(2,3)12-9-15(14(4,5)6)8-10-7-11(10)12;1-12(2,3)11-9-15(13(4,5)6)10-14(11)7-8-14;1-12(2,3)14-7-8-15(13(4,5)6)10-11(14)9-14;1-12(2,3)14-9-11(14)7-8-15(10-14)13(4,5)6;1-13(2,3)11-7-8-15(14(4,5)6)12-9-10(11)12;1-12(2,3)14-8-11-7-10(14)9-15(11)13(4,5)6;1-12(2,3)14-8-7-9-15(11-10-14)13(4,5)6;1-11(2,3)13-7-10(13)8-14(9-13)12(4,5)6;1-12(2,3)11-9-7-14(8-10(9)11)13(4,5)6;1-12(2,3)11-7-9-14(10-8-11)13(4,5)6;1-12(2,3)11-8-7-9-14(10-11)13(4,5)6;1-12(2,3)11-9-7-8-10-14(11)13(4,5)6;1-11(2,3)13-7-9-14(10-8-13)12(4,5)6;1-11(2,3)10-7-8-13(9-10)12(4,5)6;1-11(2,3)10-8-7-9-13(10)12(4,5)6;1-10(2,3)9-7-12(8-9)11(4,5)6;/h5*12H,7-11H2,1-6H3;10-12H,7-9H2,1-6H3;3*11H,7-10H2,1-6H3;10-12H,7-9H2,1-6H3;10-11H,7-9H2,1-6H3;7-11H2,1-6H3;10H,7-9H2,1-6H3;9-11H,7-8H2,1-6H3;3*11H,7-10H2,1-6H3;7-10H2,1-6H3;2*10H,7-9H2,1-6H3;9H,7-8H2,1-6H3;1H3.
What are the key properties of azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine?
azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine has a molecular weight of 4320.82 g/mol, XLogP of 70.96, 0 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,3-ditert-butyl-3-azabicyclo[4.1.0]heptane;2,5-ditert-butyl-2-azabicyclo[4.1.0]heptane;3,5-ditert-butyl-3-azabicyclo[4.1.0]heptane;3,6-ditert-butyl-3-azabicyclo[4.1.0]heptane;1,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;3,6-ditert-butyl-3-azabicyclo[3.1.0]hexane;5,7-ditert-butyl-5-azaspiro[2.4]heptane;4,6-ditert-butyl-4-azaspiro[2.5]octane;4,7-ditert-butyl-4-azaspiro[2.5]octane;5,7-ditert-butyl-5-azaspiro[2.5]octane;5,8-ditert-butyl-5-azaspiro[2.5]octane;6,8-ditert-butyl-6-azaspiro[2.5]octane;1,3-ditert-butylazetidine;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;1,4-ditert-butyl-1,4-diazepane;1,4-ditert-butylpiperazine;1,2-ditert-butylpiperidine;1,3-ditert-butylpiperidine;1,4-ditert-butylpiperidine;1,2-ditert-butylpyrrolidine;1,3-ditert-butylpyrrolidine is sourced from PubChem (CID 164948821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).