Basic information
- Standard SMILES
CNCC[C@](C)(Oc1cccc2ccccc12)c1cccs1- InChIKey
GUPBNSICSXFQNG-IBGZPJMESA-N- Molecular formula
- C19H21NOS
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.13438547
Names & identifiers
- Preferred name
- (S)-(+)-N-methyl-3-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propylamine
- IUPAC
- (3S)-N-methyl-3-naphthalen-1-yloxy-3-thiophen-2-ylbutan-1-amine
Names & synonyms
SCHEMBL2062227GUPBNSICSXFQNG-IBGZPJMESA-N(S)-(+)-N-methyl-3-methyl-3-(1-naphthyloxy)-3-(2-thienyl)propylamine
Database identifiers
- PubChem CID
- 42598152
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 49.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 350
Related reactions
2 records
Compound notes
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