Basic information
- Standard SMILES
COc1ccc2c(c1)CCN(Cc1cnc(C)nc1N)C2- InChIKey
GIEYGDRTMMTCAE-UHFFFAOYSA-N- Molecular formula
- C16H20N4O
- Average molar mass
- 284.36 g/mol
- Monoisotopic mass
- 284.16371127
Names & identifiers
- Preferred name
- 5-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methyl-pyrimidin-4-ylamine
- IUPAC
- 5-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-methylpyrimidin-4-amine
Names & synonyms
SCHEMBL7802179GIEYGDRTMMTCAE-UHFFFAOYSA-N5-(6-methoxy-3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methyl-pyrimidin-4-ylamine
Database identifiers
- PubChem CID
- 21473698
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 340
Related reactions
2 records
Compound notes
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