Benzeneethanamine, 2-methoxy-4-[(6-methyl-4-pyrimidinyl)oxy]-
Basic information
- CAS
927983-01-5- Standard SMILES
COc1cc(Oc2cc(C)ncn2)ccc1CCN- InChIKey
AZWCYQDFQQWLBY-UHFFFAOYSA-N- Molecular formula
- C14H17N3O2
- Average molar mass
- 259.3 g/mol
- Monoisotopic mass
- 259.13207679
Names & identifiers
- Preferred name
- Benzeneethanamine, 2-methoxy-4-[(6-methyl-4-pyrimidinyl)oxy]-
- IUPAC
- 2-[2-methoxy-4-(6-methylpyrimidin-4-yl)oxyphenyl]ethanamine
Names & synonyms
927983-01-5Benzeneethanamine, 2-methoxy-4-[(6-methyl-4-pyrimidinyl)oxy]-DTXSID701191916AKOS0026749772-Methoxy-4-[(6-methyl-4-pyrimidinyl)oxy]benzeneethanamine2-{2-Methoxy-4-[(6-methylpyrimidin-4-yl)oxy]phenyl}ethan-1-amine
Database identifiers
- CAS
927983-01-5- PubChem CID
- 16643302
- DTXSID
DTXSID701191916
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 70.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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