Basic information
- CAS
51024-63-6- Standard SMILES
C[NH+]1CCc2c(cccc2NC(=O)c2ccccc2F)C1.[Cl-]- InChIKey
VIAGVJQANYOLAO-UHFFFAOYSA-N- Molecular formula
- C17H18ClFN2O
- Average molar mass
- 320.8 g/mol
- Monoisotopic mass
- 320.1091691
Names & identifiers
- Preferred name
- Benzamide, 2-fluoro-N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)-, hydrochloride
- IUPAC
- 2-fluoro-N-(2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl)benzamide chloride
Names & synonyms
51024-63-6Benzamide, 2-fluoro-N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)-, hydrochlorideRefChem:1077948Isoquinoline, 1,2,3,4-tetrahydro-5-(2-fluorobenzamido)-2-methyl-, hydrochloride2-Fluoro-N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)benzamide hydrochloride
Database identifiers
- CAS
51024-63-6- PubChem CID
- 39865
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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