Basic information
- Standard SMILES
COCCC(=O)Nc1ccc(-n2ncc3c(N)ncnc32)cc1- InChIKey
RVZBOOHKOBZONU-UHFFFAOYSA-N- Molecular formula
- C15H16N6O2
- Average molar mass
- 312.33 g/mol
- Monoisotopic mass
- 312.13347377
Names & identifiers
- Preferred name
- N-[4-(4-Amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-3-methoxy-propionamide
- IUPAC
- N-[4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-3-methoxypropanamide
Names & synonyms
SCHEMBL3872198RVZBOOHKOBZONU-UHFFFAOYSA-NN-[4-(4-Amino-pyrazolo[3,4-d]pyrimidin-1-yl)-phenyl]-3-methoxy-propionamide
Database identifiers
- PubChem CID
- 11996397
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 401
Related reactions
2 records
Compound notes
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