Basic information
- Standard SMILES
CN1CCCN(c2c3c(nc4ccccc24)CCCCC3)CC1- InChIKey
YAQMVCXJRCIYFU-UHFFFAOYSA-N- Molecular formula
- C20H27N3
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.22049787
Names & identifiers
- Preferred name
- 11-(4-methyl-1,4-diazepan-1-yl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline
- IUPAC
- 11-(4-methyl-1,4-diazepan-1-yl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline
Names & synonyms
DTXSID80138449111-(4-methyl-1,4-diazepan-1-yl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline
Database identifiers
- PubChem CID
- 49706
- DTXSID
DTXSID801384491
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 19.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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