bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)

C135H269N15 — CID 157396540

IUPACbis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)
SMILESCC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CCC2(CC1)CN(C(C)C)C2.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)N1CC2(C1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCN(C(C)C)CC1
InChIInChI=1S/3C14H27N.2C13H26N2.2C12H23N.C11H22N2.2C11H23N.C10H22N2/c2*1-11(2)13-9-14(10-13)5-7-15(8-6-14)12(3)4;1-11(2)13-5-7-14(8-6-13)9-15(10-14)12(3)4;2*1-11(2)14-7-5-13(6-8-14)9-15(10-13)12(3)4;2*1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-9(2)12-5-11(6-12)7-13(8-11)10(3)4;3*1-9(2)11-5-7-12(8-6-11)10(3)4/h3*11-13H,5-10H2,1-4H3;2*11-12H,5-10H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3
InChIKeyBMQDJSRHPNHHPR-UHFFFAOYSA-N
MW2102.74 g/mol
LogP28.92
Rot. Bonds22

About bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)

bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) (PubChem CID 157396540) has the molecular formula C135H269N15 and a molecular weight of 2102.74 g/mol. Its IUPAC name is bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine).

Molecular Properties

Compound Namebis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)
PubChem CID157396540
Molecular FormulaC135H269N15
Molecular Weight2102.74 g/mol
Exact Mass2101.15
IUPAC Namebis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)
SMILESCC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CCC2(CC1)CN(C(C)C)C2.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)N1CC2(C1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCN(C(C)C)CC1
InChIInChI=1S/3C14H27N.2C13H26N2.2C12H23N.C11H22N2.2C11H23N.C10H22N2/c2*1-11(2)13-9-14(10-13)5-7-15(8-6-14)12(3)4;1-11(2)13-5-7-14(8-6-13)9-15(10-14)12(3)4;2*1-11(2)14-7-5-13(6-8-14)9-15(10-13)12(3)4;2*1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-9(2)12-5-11(6-12)7-13(8-11)10(3)4;3*1-9(2)11-5-7-12(8-6-11)10(3)4/h3*11-13H,5-10H2,1-4H3;2*11-12H,5-10H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3
InChIKeyBMQDJSRHPNHHPR-UHFFFAOYSA-N
XLogP28.92
TPSA48.60 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds22
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002102.74
LogP ≤ 528.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) with MolForge

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Related Compounds

2,6-ditert-butyl-2-azaspiro[3.3]heptane;1,3-ditert-butylcyclobutane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;1,4-ditert-butyl-3,3-difluoropiperidine;1,4-ditert-butyl-2,2-dimethylpiperazine;(3S)-1,4-ditert-butyl-3-fluoropiperidine;(3R)-1,4-ditert-butyl-3-fluoropiperidine;(2R)-1,4-ditert-butyl-2-methylpiperidine;1,4-ditert-butylpiperazine;1,4-ditert-butylpiperidine;1,3-ditert-butylpyrrolidine
CID 157061027
6-[(3S)-3-[[4-(4-tert-butylpiperazin-1-yl)-1-(2,2-dimethylpropyl)piperidin-3-yl]methyl]-1-(2,2-dimethylpropyl)piperidin-4-yl]-2-[5-[4-[(2R)-1-(2,2-dimethylpropyl)-2-methylpiperidin-4-yl]piperazin-1-yl]-2,5-dimethylhexan-2-yl]-2,6-diazaspiro[3.3]heptane
CID 134492951
(3R,4R)-3-tert-butyl-1-cyclobutyl-4-ethylpiperidine;(3R,4S)-3-tert-butyl-1-cyclobutyl-4-(2-methylpropyl)piperidine;(3S,4S)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine;(3R,4S)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine;(3R,4R)-1-cyclobutyl-4-ethyl-3-propan-2-ylpiperidine;(3R,4S)-1-cyclobutyl-4-(2-methylpropyl)-3-propan-2-ylpiperidine;(3S,4R)-1-cyclobutyl-4-(2-methylpropyl)-3-propan-2-ylpiperidine;(3R,4R)-1-cyclobutyl-4-(2-methylpropyl)-3-propan-2-ylpiperidine;(3S,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine;(3R,4R)-1-cyclobutyl-3-propan-2-yl-4-propylpiperidine
CID 157096519
1-[2-(1-tert-butylazetidin-3-yl)ethyl]-4-propan-2-ylpiperazine;1-tert-butyl-4-[(3-tert-butylazetidin-1-yl)methyl]piperidine;1-tert-butyl-4-(1-tert-butylazetidin-3-yl)piperidine;4-tert-butyl-1-(1-tert-butylazetidin-3-yl)piperidine;1-tert-butyl-4-[2-(1-tert-butylpiperidin-4-yl)ethyl]piperazine;1-tert-butyl-4-[[(3S)-1-tert-butylpiperidin-3-yl]methyl]piperazine;3-tert-butyl-1-(5,5-dimethylhexyl)azetidine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;4-tert-butyl-1-[1-(2,2-dimethylpropyl)azetidin-3-yl]piperidine;4-(4,4-dimethylpentyl)-1-methyl-1-propan-2-ylpiperazin-1-ium
CID 157246839
2-(3-tert-butylazetidin-1-yl)-N,N-dimethylethanamine;4-(3-tert-butylazetidin-1-yl)-1-methylpiperidine;1-butyl-3-tert-butylazetidine;bis(tert-butylcyclobutane);tert-butylcyclohexane;4-tert-butyl-1-cyclohexylpiperidine;tert-butylcyclopentane;3-tert-butyl-1-methylazetidine;4-tert-butyl-1-methylpiperidine;3-tert-butyl-1-methylpyrrolidine;4-tert-butyl-1-propylpiperidine;N-(3,3-dimethylbutyl)-N,1-dimethylazetidin-3-amine;1-(3,3-dimethylbutyl)-4-methylpiperazine;1-(3,3-dimethylbutyl)piperazine;1-(3,3-dimethylbutyl)piperidine;bis(2,2-dimethylpentane);3-(2,2-dimethylpropyl)-1-methylazetidine;N,N,3,3-tetramethylbutan-1-amine;N,3,3-trimethylbutan-1-amine
CID 157751354
3-Propan-2-yl-3-aza-6-azanidabicyclo[3.1.1]heptane;6-propan-2-yl-6-aza-3-azanidabicyclo[3.1.1]heptane;3-propan-2-yl-6-azanidabicyclo[3.1.1]heptane;tris(yttrium)
CID 158888370
4-tert-butyl-1-[(1-tert-butylazetidin-3-yl)methyl]piperidine;4-tert-butyl-1-(1-tert-butylazetidin-3-yl)piperidine;1-tert-butyl-4-[(1-tert-butylpiperidin-4-yl)methyl]piperazine;1-tert-butyl-4-[[(3R)-1-tert-butylpiperidin-3-yl]methyl]piperazine;1-tert-butyl-4-[(4-tert-butylpiperidin-1-yl)methyl]piperidine;(3R)-1-tert-butyl-3-[(4-tert-butylpiperidin-1-yl)methyl]piperidine;4-tert-butyl-1-[[(3S)-1-tert-butylpyrrolidin-3-yl]methyl]piperidine;3-tert-butyl-9-(5,5-dimethylhexyl)-3,9-diazaspiro[5.5]undecane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
CID 160063488
1-tert-butyl-4-[2-(1-tert-butylazetidin-3-yl)ethyl]piperazine;1-tert-butyl-4-[(3-tert-butylazetidin-1-yl)methyl]piperidine;1-tert-butyl-4-(1-tert-butylazetidin-3-yl)piperidine;4-tert-butyl-1-(1-tert-butylazetidin-3-yl)piperidine;1-tert-butyl-4-[2-(1-tert-butylpiperidin-4-yl)ethyl]piperazine;1-tert-butyl-4-[[(3S)-1-tert-butylpiperidin-3-yl]methyl]piperazine;3-tert-butyl-1-(5,5-dimethylhexyl)azetidine;4-tert-butyl-1-(4,4-dimethylpentyl)-4-methylpiperidine;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine
CID 160334265
2,6-Di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;2,8-di(propan-2-yl)-2,8-diazaspiro[5.5]undecane;2,9-di(propan-2-yl)-2,9-diazaspiro[5.5]undecane;3,9-di(propan-2-yl)-3,9-diazaspiro[5.5]undecane
CID 162027149
1-Tert-butyl-4-(4,4-dimethylpent-2-ynyl)piperazine;2-tert-butyl-6-(2,2-dimethylpropyl)-1,3,4,4a,5,7,8,8a-octahydro-2,6-naphthyridine;2-tert-butyl-7-(2,2-dimethylpropyl)-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;4-tert-butyl-1-[1-(2,2-dimethylpropyl)azetidin-3-yl]piperidine;4-tert-butyl-1-[3-(2,2-dimethylpropyl)cyclobutyl]-4-methylpiperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;2,7-ditert-butyl-1,3,4,4a,5,6,8,8a-octahydro-2,7-naphthyridine;2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane;2,8-ditert-butyl-2,8-diazaspiro[3.5]nonane
CID 162166145
8-Tert-butyl-2-propan-2-yl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2-azaspiro[3.3]heptane;3,9-ditert-butyl-3-azaspiro[5.5]undecane;2,8-ditert-butyl-2,8-diazaspiro[4.5]decane;2,6-ditert-butyl-2,6-diazaspiro[3.3]heptane;2,7-ditert-butyl-2,7-diazaspiro[3.5]nonane;3,9-ditert-butyl-3,9-diazaspiro[5.5]undecane
CID 164984112
3,6-Ditert-butyl-6-azabicyclo[3.1.1]heptane;2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;bis(3,6-ditert-butyl-3,6-diazabicyclo[3.1.1]heptane);1,4-ditert-butylpiperazine;bis(1,4-ditert-butylpiperidine)
CID 164989429

Frequently Asked Questions

What is the IUPAC name of bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)?
The IUPAC name of bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) (CID 157396540) is bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine).
What is the SMILES notation for bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)?
The canonical SMILES for bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) is CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(C1)CN(C(C)C)C2.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CC2(CCN(C(C)C)CC2)C1.CC(C)C1CCC2(CC1)CN(C(C)C)C2.CC(C)C1CCN(C(C)C)CC1.CC(C)C1CCN(C(C)C)CC1.CC(C)N1CC2(C1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCC2(CC1)CN(C(C)C)C2.CC(C)N1CCN(C(C)C)CC1.
What is the InChIKey of bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)?
The InChIKey is BMQDJSRHPNHHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C14H27N.2C13H26N2.2C12H23N.C11H22N2.2C11H23N.C10H22N2/c2*1-11(2)13-9-14(10-13)5-7-15(8-6-14)12(3)4;1-11(2)13-5-7-14(8-6-13)9-15(10-14)12(3)4;2*1-11(2)14-7-5-13(6-8-14)9-15(10-13)12(3)4;2*1-9(2)11-5-12(6-11)7-13(8-12)10(3)4;1-9(2)12-5-11(6-12)7-13(8-11)10(3)4;3*1-9(2)11-5-7-12(8-6-11)10(3)4/h3*11-13H,5-10H2,1-4H3;2*11-12H,5-10H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3;2*9-11H,5-8H2,1-4H3;9-10H,5-8H2,1-4H3.
What are the key properties of bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine)?
bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) has a molecular weight of 2102.74 g/mol, XLogP of 28.92, 22 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,6-di(propan-2-yl)-2-azaspiro[3.3]heptane);2,7-di(propan-2-yl)-2-azaspiro[3.5]nonane;bis(2,7-di(propan-2-yl)-7-azaspiro[3.5]nonane);2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane;bis(2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane);1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine) is sourced from PubChem (CID 157396540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).