Basic information
- CAS
356092-37-0- Standard SMILES
COc1ccc(CNC2CCCc3ccccc32)c(OC)c1- InChIKey
STSLPNQNBVMGPK-UHFFFAOYSA-N- Molecular formula
- C19H23NO2
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.17287898
Names & identifiers
- Preferred name
- N-[(2,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
- IUPAC
- N-[(2,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
Names & synonyms
356092-37-0(2,4-DIMETHOXYBENZYL)1,2,3,4-TETRAHYDRONAPHTHALEN-1-YLAMINEN-[(2,4-dimethoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amineHMS2818O19Oprea1_457075Oprea1_866539MLS001164402CHEMBL1389171DTXSID00386033AKOS003260116SMR000496601DB-179085
Show more names
N-[(2,4-dimethoxyphenyl)methyl]tetralin-1-amineSR-01000212221SR-01000212221-1(2,4-dimethoxybenzyl)1,2,3,4-tetrahydro-1-naphthalenylamine
Database identifiers
- CAS
356092-37-0- PubChem CID
- 2851249
- DTXSID
DTXSID00386033- ChEMBL
CHEMBL1389171
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 335
Experimental & physicochemical properties
Solubility31.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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