8-Azabicyclo(4.3.0)nonane, 8-(diethylaminoethyl)-
Basic information
- CAS
73855-67-1- Standard SMILES
CCN(CC)CCN1CC2CCCCC2C1- InChIKey
LDWNBSDGQACSSP-UHFFFAOYSA-N- Molecular formula
- C14H28N2
- Average molar mass
- 224.39 g/mol
- Monoisotopic mass
- 224.2252489
Names & identifiers
- Preferred name
- 8-Azabicyclo(4.3.0)nonane, 8-(diethylaminoethyl)-
- IUPAC
- 2-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-N,N-diethylethanamine
Names & synonyms
73855-67-18-Azabicyclo(4.3.0)nonane, 8-(diethylaminoethyl)-RefChem:10746592H-Isoindole-2-ethanamine, N,N-diethyloctahydro-8-Azabicyclo(4.3.0)nonane, (8-(diethylamino)ethyl)-8-Azabicyclo[4.3.0]nonane, [8-(diethylamino)ethyl]-NSC 220117BRN 00027798-(Diethylaminoethyl)-8-azabicyclo(4.3.0)-nonaneNSC2201174-20-00-01984 (Beilstein Handbook Reference)DTXSID00994995
Show more names
WLN: T56 CNTJ C2N2&2NSC-2201172H-Isoindole-2-ethanamine,N-diethyloctahydro-[8-(Diethylamino)ethyl]-8-azabicyclo[4.3.0]nonaneN,N-Diethyl-2-(octahydro-2H-isoindol-2-yl)ethan-1-amine
Database identifiers
- CAS
73855-67-1- PubChem CID
- 99792
- DTXSID
DTXSID00994995
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 187
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Compound notes
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