Basic information
- CAS
5778-91-6- Standard SMILES
CCc1cccc2c(N)c3c(nc12)CCCCC3- InChIKey
RYYIJELDJXNYTR-UHFFFAOYSA-N- Molecular formula
- C16H20N2
- Average molar mass
- 240.34 g/mol
- Monoisotopic mass
- 240.16264865
Names & identifiers
- Preferred name
- 6H-Cyclohepta(b)quinoline, 7,8,9,10-tetrahydro-11-amino-4-ethyl-
- IUPAC
- 4-ethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
Names & synonyms
5778-91-6MAS 763BRN 03993946H-CYCLOHEPTA(b)QUINOLINE, 7,8,9,10-TETRAHYDRO-11-AMINO-4-ETHYL-7,8,9,10-Tetrahydro-11-amino-4-ethyl-6H-cyclohepta(b)quinolineDTXSID90206473RefChem:309560DTXCID901289644-ethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amineAKOS012656131
Database identifiers
- CAS
5778-91-6- PubChem CID
- 22010
- DTXSID
DTXSID90206473- Nikkaji
- J63.324K
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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