CID 54599709
Basic information
- CAS
5339-94-6- Standard SMILES
COc1cc(NCCCCCNC2CCCCC2)c2ncccc2c1.Cl- InChIKey
ZAZQANVATPOXCS-UHFFFAOYSA-N- Molecular formula
- C21H32ClN3O
- Average molar mass
- 377.9 g/mol
- Monoisotopic mass
- 377.2233903
Names & identifiers
- Preferred name
- CID 54599709
- IUPAC
- N-cyclohexyl-N'-(6-methoxyquinolin-8-yl)pentane-1,5-diamine;hydrochloride
Names & synonyms
5339-94-6DTXSID40712817NSC3588NSC-3588N-cyclohexyl-N'-(6-methoxyquinolin-8-yl)pentane-1,5-diamine;hydrochlorideN~1~-Cyclohexyl-N~5~-(6-methoxyquinolin-8-yl)pentane-1,5-diamine--hydrogen chloride (1/1)
Database identifiers
- CAS
5339-94-6- PubChem CID
- 54599709
- DTXSID
DTXSID40712817
Properties
Computed structural properties
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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