Basic information
- Standard SMILES
Nc1nccc2ccc(CN3CCC(N)C3=O)cc12- InChIKey
ZMOKFOPJBQAHGO-UHFFFAOYSA-N- Molecular formula
- C14H16N4O
- Average molar mass
- 256.3 g/mol
Names & identifiers
- Preferred name
- 3-Amino-1-[(1-aminoisoquinolin-7-yl)methyl]pyrrolidin-2-one
- IUPAC
- 3-amino-1-[(1-aminoisoquinolin-7-yl)methyl]pyrrolidin-2-one
Names & synonyms
SCHEMBL23752547
Database identifiers
- PubChem CID
- 18176301
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 348
Related reactions
1 records
Compound notes
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