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

C189H380N16 — CID 162157713

IUPAC2,5-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
SMILESCC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2CC1CN2C(C)C.CC(C)C1CCC2(CCCN(C(C)C)C2)CC1.CC(C)C1CCC[C@@H](C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CN(C(C)C)C1.CC(C)C[C@@H]1CCCN(C(C)C)C1.CC(C)N1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CC2CC1N(C(C)C)C2.CC(C)[C@@H]1CC2CCC1N(C(C)C)C2.CC(C)[C@@H]1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CCCCN1C(C)C.CC(C)[C@@H]1CCCN(C(C)C)C1.CC(C)[C@@H]1CCCN1C(C)C.CC(C)[C@@H]1CCN(C(C)C)C1.CC(C)[C@@H]1CCN1C(C)C
InChIInChI=1S/C16H31N.C15H29N.C14H28N2.C13H25N.3C12H23N.C12H25N.C12H24.3C11H23N.2C10H21N.2C9H19N/c1-13(2)15-6-9-16(10-7-15)8-5-11-17(12-16)14(3)4;1-12(2)14-6-5-7-15(10-14)8-9-16(11-15)13(3)4;1-12(2)15-8-5-6-14(10-15)7-9-16(11-14)13(3)4;1-9(2)12-7-11-5-6-13(12)14(8-11)10(3)4;1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-8(2)12-6-11-5-10(12)7-13(11)9(3)4;1-8(2)11-5-10-6-12(11)13(7-10)9(3)4;1-10(2)8-12-6-5-7-13(9-12)11(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-7-5-6-8-12(11)10(3)4;1-8(2)10-5-6-11(7-10)9(3)4;1-8(2)10-6-5-7-11(10)9(3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)9-5-6-10(9)8(3)4/h13-15H,5-12H2,1-4H3;12-14H,5-11H2,1-4H3;12-13H,5-11H2,1-4H3;9-13H,5-8H2,1-4H3;9-11H,5-8H2,1-4H3;2*8-12H,5-7H2,1-4H3;10-12H,5-9H2,1-4H3;9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;2*8-10H,5-7H2,1-4H3;2*7-9H,5-6H2,1-4H3/t;14-,15?;;11?,12-,13?;;;10?,11-,12?;12-;11-,12?;;2*11-;2*10-;;9-/m.1.0..001.1010.0/s1
InChIKeyZMAZMLNQDCMZPP-KPVKAVEWSA-N
MW2877.23 g/mol
LogP46.97
Rot. Bonds33

About 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

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 (PubChem CID 162157713) has the molecular formula C189H380N16 and a molecular weight of 2877.23 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2,5-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
PubChem CID162157713
Molecular FormulaC189H380N16
Molecular Weight2877.23 g/mol
Exact Mass2875.02
IUPAC Name2,5-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
SMILESCC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2CC1CN2C(C)C.CC(C)C1CCC2(CCCN(C(C)C)C2)CC1.CC(C)C1CCC[C@@H](C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CN(C(C)C)C1.CC(C)C[C@@H]1CCCN(C(C)C)C1.CC(C)N1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CC2CC1N(C(C)C)C2.CC(C)[C@@H]1CC2CCC1N(C(C)C)C2.CC(C)[C@@H]1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CCCCN1C(C)C.CC(C)[C@@H]1CCCN(C(C)C)C1.CC(C)[C@@H]1CCCN1C(C)C.CC(C)[C@@H]1CCN(C(C)C)C1.CC(C)[C@@H]1CCN1C(C)C
InChIInChI=1S/C16H31N.C15H29N.C14H28N2.C13H25N.3C12H23N.C12H25N.C12H24.3C11H23N.2C10H21N.2C9H19N/c1-13(2)15-6-9-16(10-7-15)8-5-11-17(12-16)14(3)4;1-12(2)14-6-5-7-15(10-14)8-9-16(11-15)13(3)4;1-12(2)15-8-5-6-14(10-15)7-9-16(11-14)13(3)4;1-9(2)12-7-11-5-6-13(12)14(8-11)10(3)4;1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-8(2)12-6-11-5-10(12)7-13(11)9(3)4;1-8(2)11-5-10-6-12(11)13(7-10)9(3)4;1-10(2)8-12-6-5-7-13(9-12)11(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-7-5-6-8-12(11)10(3)4;1-8(2)10-5-6-11(7-10)9(3)4;1-8(2)10-6-5-7-11(10)9(3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)9-5-6-10(9)8(3)4/h13-15H,5-12H2,1-4H3;12-14H,5-11H2,1-4H3;12-13H,5-11H2,1-4H3;9-13H,5-8H2,1-4H3;9-11H,5-8H2,1-4H3;2*8-12H,5-7H2,1-4H3;10-12H,5-9H2,1-4H3;9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;2*8-10H,5-7H2,1-4H3;2*7-9H,5-6H2,1-4H3/t;14-,15?;;11?,12-,13?;;;10?,11-,12?;12-;11-,12?;;2*11-;2*10-;;9-/m.1.0..001.1010.0/s1
InChIKeyZMAZMLNQDCMZPP-KPVKAVEWSA-N
XLogP46.97
TPSA51.84 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds33
Heavy Atoms205
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002877.23
LogP ≤ 546.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 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 with MolForge

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Related Compounds

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
N,3-dimethyl-N-propan-2-ylbutan-1-amine;2,5-di(propan-2-yl)-2-azabicyclo[2.2.1]heptane;2,6-di(propan-2-yl)-2-azabicyclo[2.2.1]heptane;2,6-di(propan-2-yl)-2-azabicyclo[2.2.2]octane;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;1,2-di(propan-2-yl)azetidine;1,3-di(propan-2-yl)azetidine;1,3-di(propan-2-yl)cyclohexane;2,9-di(propan-2-yl)-2,9-diazaspiro[4.5]decane;1,2-di(propan-2-yl)piperidine;1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;1,2-di(propan-2-yl)pyrrolidine;1,3-di(propan-2-yl)pyrrolidine;3-methyl-N-propan-2-ylbutan-1-amine;3-(2-methylpropyl)-1-propan-2-ylpiperidine
CID 159321294
CID 159426108
CID 159426108
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
2,8-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;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;2,7-ditert-butyl-2,7-diazaspiro[3.4]octane;3,8-ditert-butylspiro[4.5]decane;2,7-ditert-butylspiro[3.5]nonane;3,8-ditert-butylspiro[4.4]nonane
CID 163557403
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
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
1,4-diethylcyclohexane;2,5-dimethyl-2-azabicyclo[2.2.1]heptane;(3R)-3,8-dimethyl-8-azaspiro[4.5]decane;2,6-dimethyl-2-azaspiro[3.3]heptane;2,7-dimethyl-2-azaspiro[3.5]nonane;2,7-dimethyl-7-azaspiro[3.5]nonane;(8R)-2,8-dimethyl-2-azaspiro[4.4]nonane;2,6-dimethyl-6-azaspiro[3.4]octane;(6R)-2,6-dimethyl-2-azaspiro[3.4]octane;1,3-dimethylazetidine;N,3-dimethylcyclobutan-1-amine;N,4-dimethylcyclohexan-1-amine;1,4-dimethylpiperidine;(3S)-1,3-dimethylpyrrolidine;1-(3-ethylcyclobutyl)-N-methylmethanamine;1-(4-ethylcyclohexyl)-N-methylmethanamine;1-(3-ethylcyclopentyl)-N-methylmethanamine;3-ethyl-1-methylazetidine;1-ethyl-3-methylcyclobutane;3-ethyl-N-methylcyclopentan-1-amine;(3S)-1-ethyl-3-methylcyclopentane;4-ethyl-1-methylpiperidine;3-ethyl-1-methylpyrrolidine;N-methyl-1-[(3S)-3-methylcyclopentyl]methanamine;1-methyl-3-propylcyclobutane;1-methyl-4-propylcyclohexane
CID 167563097

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2CC1CN2C(C)C.CC(C)C1CCC2(CCCN(C(C)C)C2)CC1.CC(C)C1CCC[C@@H](C(C)C)C1.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CN(C(C)C)C1.CC(C)C[C@@H]1CCCN(C(C)C)C1.CC(C)N1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CC2CC1N(C(C)C)C2.CC(C)[C@@H]1CC2CCC1N(C(C)C)C2.CC(C)[C@@H]1CCCC2(CCN(C(C)C)C2)C1.CC(C)[C@@H]1CCCCN1C(C)C.CC(C)[C@@H]1CCCN(C(C)C)C1.CC(C)[C@@H]1CCCN1C(C)C.CC(C)[C@@H]1CCN(C(C)C)C1.CC(C)[C@@H]1CCN1C(C)C.
What is the InChIKey of 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?
The InChIKey is ZMAZMLNQDCMZPP-KPVKAVEWSA-N. The full InChI is InChI=1S/C16H31N.C15H29N.C14H28N2.C13H25N.3C12H23N.C12H25N.C12H24.3C11H23N.2C10H21N.2C9H19N/c1-13(2)15-6-9-16(10-7-15)8-5-11-17(12-16)14(3)4;1-12(2)14-6-5-7-15(10-14)8-9-16(11-15)13(3)4;1-12(2)15-8-5-6-14(10-15)7-9-16(11-14)13(3)4;1-9(2)12-7-11-5-6-13(12)14(8-11)10(3)4;1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-8(2)12-6-11-5-10(12)7-13(11)9(3)4;1-8(2)11-5-10-6-12(11)13(7-10)9(3)4;1-10(2)8-12-6-5-7-13(9-12)11(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-5-7-12(8-6-11)10(3)4;1-9(2)11-6-5-7-12(8-11)10(3)4;1-9(2)11-7-5-6-8-12(11)10(3)4;1-8(2)10-5-6-11(7-10)9(3)4;1-8(2)10-6-5-7-11(10)9(3)4;1-7(2)9-5-10(6-9)8(3)4;1-7(2)9-5-6-10(9)8(3)4/h13-15H,5-12H2,1-4H3;12-14H,5-11H2,1-4H3;12-13H,5-11H2,1-4H3;9-13H,5-8H2,1-4H3;9-11H,5-8H2,1-4H3;2*8-12H,5-7H2,1-4H3;10-12H,5-9H2,1-4H3;9-12H,5-8H2,1-4H3;3*9-11H,5-8H2,1-4H3;2*8-10H,5-7H2,1-4H3;2*7-9H,5-6H2,1-4H3/t;14-,15?;;11?,12-,13?;;;10?,11-,12?;12-;11-,12?;;2*11-;2*10-;;9-/m.1.0..001.1010.0/s1.
What are the key properties of 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?
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 has a molecular weight of 2877.23 g/mol, XLogP of 46.97, 33 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 162157713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).