Basic information
- Standard SMILES
COc1ccc2cc(-c3ccnc(N(C)C)n3)cc(NC3CCNCC3)c2c1- InChIKey
JANGXIGJNKFEDW-UHFFFAOYSA-N- Molecular formula
- C22H27N5O
- Average molar mass
- 377.5 g/mol
Names & identifiers
- Preferred name
- 4-[6-methoxy-4-(piperidin-4-ylamino)naphthalen-2-yl]-N,N-dimethylpyrimidin-2-amine
- IUPAC
- 4-[6-methoxy-4-(piperidin-4-ylamino)naphthalen-2-yl]-N,N-dimethylpyrimidin-2-amine
Names & synonyms
SCHEMBL2180900
Database identifiers
- PubChem CID
- 53258409
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 484
Related reactions
2 records
Compound notes
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