Basic information
- CAS
65021-83-2- Standard SMILES
CC1CCC2CN(C3CCCCC3)CC2C1- InChIKey
DWRIQLHPMRIGHK-UHFFFAOYSA-N- Molecular formula
- C15H27N
- Average molar mass
- 221.38 g/mol
- Monoisotopic mass
- 221.21434987
Names & identifiers
- Preferred name
- 2-Cyclohexyl-5-methyloctahydro-1H-isoindole
- IUPAC
- 2-cyclohexyl-5-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
Names & synonyms
65021-83-2DTXSID309835742-Cyclohexyl-5-methyloctahydro-1H-isoindoleRefChem:1062935DTXCID8014108082-Cyclohexyl-5-methylhexahydroisoindolineBRN 1680812ISOINDOLINE, HEXAHYDRO-2-CYCLOHEXYL-5-METHYL-5-20-04-00414 (Beilstein Handbook Reference)
Database identifiers
- CAS
65021-83-2- PubChem CID
- 47516
- DTXSID
DTXSID30983574- Nikkaji
- J68.627A
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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