Pyridine, 3-(((alpha-methylphenethyl)amino)methyl)-, maleate (1:1)
Basic information
- CAS
16562-21-3- Standard SMILES
CC(Cc1ccccc1)NCc1cccnc1.O=C(O)/C=C/C(=O)O- InChIKey
MPAYFZQPAONMNF-WLHGVMLRSA-N- Molecular formula
- C19H22N2O4
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.15795719
Names & identifiers
- Preferred name
- Pyridine, 3-(((alpha-methylphenethyl)amino)methyl)-, maleate (1:1)
- IUPAC
- (E)-but-2-enedioic acid;1-phenyl-N-(pyridin-3-ylmethyl)propan-2-amine
Names & synonyms
Pyridine, 3-(((alpha-methylphenethyl)amino)methyl)-, maleate (1:1)16562-21-3RefChem:1097287BS-253-(((alpha-Methylphenethyl)amino)methyl)pyridine maleateSCHEMBL29776292
Database identifiers
- CAS
16562-21-3- PubChem CID
- 6444740
Properties
Computed structural properties
- Topological polar surface area
- 99.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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