Basic information
- Standard SMILES
O=C1CCCN1CCCNc1c([N+](=O)[O-])cnc2cc(-c3ccccc3)ccc12- InChIKey
RHAAUFMXBDIXBJ-UHFFFAOYSA-N- Molecular formula
- C22H22N4O3
- Average molar mass
- 390.4 g/mol
- Monoisotopic mass
- 390.16919058
Names & identifiers
- Preferred name
- 1-[3-(3-Nitro-7-phenylquinolin-4-ylamino)propyl]pyrrolidin-2-one
- IUPAC
- 1-[3-[(3-nitro-7-phenylquinolin-4-yl)amino]propyl]pyrrolidin-2-one
Names & synonyms
SCHEMBL3861009RHAAUFMXBDIXBJ-UHFFFAOYSA-N1-[3-(3-nitro-7-phenylquinolin-4-ylamino)propyl]pyrrolidin-2-one
Database identifiers
- PubChem CID
- 21984079
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 91.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 575
Related reactions
3 records
Compound notes
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