Basic information
- CAS
54087-47-7- Standard SMILES
CC1(C)C(=O)NC(c2ccc(NC(=O)CN3CCOCC3)cc2)c2ccccc21- InChIKey
MLRWWLPZXUSTOO-UHFFFAOYSA-N- Molecular formula
- C23H27N3O3
- Average molar mass
- 393.5 g/mol
- Monoisotopic mass
- 393.20524173
Names & identifiers
- Preferred name
- Acetanilide, 4'-(4,4-dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinol-1-yl)-2-(morpholino)-
- IUPAC
- N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]-2-morpholin-4-ylacetamide
- English name
- 4'-(4,4-Dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-morpholinoacetanilide
- Molecular formula
- C23H27N3O3
- Molecular weight
- 393.48
Names & synonyms
BRN 123122354087-47-74'-(4,4-Dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)-2-morpholinoacetanilideN-(4-(4,4-Dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)phenyl)-2-morpholinoacetamideAcetamide, N-(4-(4,4-dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)phenyl)-2-morpholino-Acetanilide, 4'-(4,4-dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinol-1-yl)-2-(morpholino)-RefChem:315788CHEMBL3277859DTXSID00968934DB-3050124'-(4,4-Dimethyl-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-morpholinoacetanilideN-[4-(3-Hydroxy-4,4-dimethyl-1,4-dihydroisoquinolin-1-yl)phenyl]-2-(morpholin-4-yl)acetamide
Show more names
4-Morpholineacetamide, N-[4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl]-
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 594
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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