Basic information
- CAS
41958-61-6- Standard SMILES
C[C@H]1C(c2ccccc2)c2cc(N)ccc2CN1C- InChIKey
CSUHFLUDKKMUSA-WHUIICBVSA-N- Molecular formula
- C17H20N2
- Average molar mass
- 252.35 g/mol
- Monoisotopic mass
- 252.16264865
Names & identifiers
- Preferred name
- 2,3-Dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-6-amine
- IUPAC
- (3S)-2,3-dimethyl-4-phenyl-3,4-dihydro-1H-isoquinolin-6-amine
Names & synonyms
DTXSID6096211041958-61-62,3-Dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-6-amineRefChem:1059463DTXCID501389923BRN 0410849trans-6-Amino-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolineIsoquinoline, 6-amino-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydro-, (E)-ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6-AMINO-2,3-DIMETHYL-4-PHENYL-, (E)-(3S)-2,3-Dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-6-amine
Database identifiers
- CAS
41958-61-6- PubChem CID
- 39061
- DTXSID
DTXSID60962110
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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