Basic information
- Standard SMILES
O=C1CCC(c2cncc(Br)c2)N1- InChIKey
ASQYHAFTYONKOX-UHFFFAOYSA-N- Molecular formula
- C9H9BrN2O
- Average molar mass
- 241.08 g/mol
Names & identifiers
- Preferred name
- 5-(5-Bromopyridin-3-YL)pyrrolidin-2-one
- IUPAC
- 5-(5-bromo-3-pyridinyl)pyrrolidin-2-one
Names & synonyms
5-(5-BROMOPYRIDIN-3-YL)PYRROLIDIN-2-ONE1633013-57-6SCHEMBL16196252ASQYHAFTYONKOX-UHFFFAOYSA-NAT414605-(5-Bromo-3-pyridinyl)-2-pyrrolidinoneDB-4131325-(5-bromo-pyridin-3-yl)-pyrrolidin-2-one
Database identifiers
- PubChem CID
- 117667495
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 210
Related reactions
2 records
Linked notes
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