2H-Quinolizine, octahydro-1-(1H-indol-3-yl)-
Basic information
- CAS
118687-87-9- Standard SMILES
c1ccc2c(C3CCCN4CCCCC34)c[nH]c2c1- InChIKey
HRCHVCCGADGSSF-UHFFFAOYSA-N- Molecular formula
- C17H22N2
- Average molar mass
- 254.37 g/mol
- Monoisotopic mass
- 254.17829871
Names & identifiers
- Preferred name
- 2H-Quinolizine, octahydro-1-(1H-indol-3-yl)-
- IUPAC
- 1-(1H-indol-3-yl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
Names & synonyms
2H-Quinolizine, octahydro-1-(1H-indol-3-yl)-118687-87-9RefChem:1065338Octahydro-1-(1H-indol-3-yl)-2H-quinolizineNSC610530NSC-610530
Database identifiers
- CAS
118687-87-9- PubChem CID
- 355886
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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