1,2,3,4-Tetrahydro-5,6-dimethoxy-4-methyl-2-naphthalenamine
Basic information
- CAS
178486-82-3- Standard SMILES
COc1ccc2c(c1OC)C(C)CC(N)C2- InChIKey
ULDMWKDYEXHYFI-UHFFFAOYSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- 1,2,3,4-Tetrahydro-5,6-dimethoxy-4-methyl-2-naphthalenamine
- IUPAC
- 5,6-dimethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
Names & synonyms
SCHEMBL73326381,2,3,4-Tetrahydro-5,6-dimethoxy-4-methyl-2-naphthalenamineDTXSID101189197178486-82-35,6-dimethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
Database identifiers
- CAS
178486-82-3- PubChem CID
- 23224917
- DTXSID
DTXSID101189197
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
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Compound notes
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