Basic information
- Standard SMILES
CN1C(=O)C(Br)(Br)CC1c1cncc(Br)c1- InChIKey
OHQDXERYLUHFML-UHFFFAOYSA-N- Molecular formula
- C10H9Br3N2O
- Average molar mass
- 412.9 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-3-(3,3-dibromo-1-methyl-5-pyrrolidin-2-onyl)pyridine
- IUPAC
- 3,3-dibromo-5-(5-bromo-3-pyridinyl)-1-methylpyrrolidin-2-one
Names & synonyms
SCHEMBL6961642OHQDXERYLUHFML-UHFFFAOYSA-N5-bromo-3-(3,3-dibromo-1-methyl-5-pyrrolidin-2-onyl)pyridine5-bromo-3-(3,3-dibromo -1-methyl-5-pyrrolidin-2-onyl)pyridine
Database identifiers
- PubChem CID
- 19694330
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 298
Related reactions
5 records
Linked notes
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