3,8-Diazabicyclo(3.2.1)octane, 3,8-di(3-methyl-2-butenyl)-

HCID 3051618

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Basic information

CAS: 67571-82-8
Standard SMILES: CC(C)=CCN1CC2CCC(C1)N2CC=C(C)C
InChIKey: HUPYXFOFAIIBOP-UHFFFAOYSA-N
Molecular formula: C16H28N2
Average molar mass: 248.41 g/mol
Monoisotopic mass: 248.2252489

Names & identifiers

Preferred name: 3,8-Diazabicyclo(3.2.1)octane, 3,8-di(3-methyl-2-butenyl)-
IUPAC: 3,8-bis(3-methylbut-2-enyl)-3,8-diazabicyclo[3.2.1]octane

Names & synonyms

BRN 05214803,8-Di(3-methyl-2-butenyl)-3,8-diazabicyclo(3.2.1)octane67571-82-83,8-Diazabicyclo(3.2.1)octane, 3,8-di(3-methyl-2-butenyl)-3,8-Bis-(3,3-dimetilallil)-3,8-diazabiciclo(3.2.1)ottano [Italian]5-23-03-00467 (Beilstein Handbook Reference)3,8-Bis-(3,3-dimetilallil)-3,8-diazabiciclo(3.2.1)ottano3,8-Diazabicyclo(3.2.1)octane, 3,8-bis(3-methyl-2-butenyl)-RefChem:272664DTXSID409869303,8-Bis(3-methylbut-2-en-1-yl)-3,8-diazabicyclo[3.2.1]octane

Database identifiers

CAS: 67571-82-8
PubChem CID: 3051618
DTXSID: DTXSID40986930
Nikkaji: J68.430I

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 6.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 321

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