Basic information
- Standard SMILES
CC[C@](O)(c1cccc(N)c1)[C@@H](C)CN(C)C- InChIKey
SCZGQTRPAVMTQE-SMDDNHRTSA-N- Molecular formula
- C14H24N2O
- Average molar mass
- 236.35 g/mol
- Monoisotopic mass
- 236.18886339
Names & identifiers
- Preferred name
- (2S,3R)-3-(3-Amino-phenyl)-1-(dimethylamino)-2-methyl-pentan-3-ol
- IUPAC
- (2S,3R)-3-(3-aminophenyl)-1-(dimethylamino)-2-methylpentan-3-ol
Names & synonyms
SCHEMBL12099586SCZGQTRPAVMTQE-SMDDNHRTSA-N(2S,3R)-3-(3-Amino-phenyl)-1-(dimethylamino)-2-methyl-pentan-3-ol
Database identifiers
- PubChem CID
- 70664504
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 49.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 232
Related reactions
1 records
Compound notes
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