Basic information
- Standard SMILES
COc1cccc2c1C[C@@H](NC(C)C)CO2- InChIKey
SUJQUVASFIQQMH-SNVBAGLBSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- (R)-3-(N-Isopropylamino)-5-methoxychroman
- IUPAC
- (3R)-5-methoxy-N-propan-2-yl-3,4-dihydro-2H-chromen-3-amine
Names & synonyms
SCHEMBL7619405SUJQUVASFIQQMH-SNVBAGLBSA-N(R)-3-(N-Isopropylamino)-5-methoxychroman(r)-3-(n-isopropylamino)-5-methoxy-3,4-dihydro-2h-1-benzopyran
Database identifiers
- PubChem CID
- 10489181
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 220
Related reactions
13 records
Compound notes
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