Basic information
- Standard SMILES
O=C(NC1CCNC1)c1cccc(Br)c1- InChIKey
CZPCRXDUPVHYFW-UHFFFAOYSA-N- Molecular formula
- C11H13BrN2O
- Average molar mass
- 269.14 g/mol
- Monoisotopic mass
- 268.02113
Names & identifiers
- Preferred name
- 3-bromo-N-pyrrolidin-3-yl-benzamide
- IUPAC
- 3-bromo-N-pyrrolidin-3-ylbenzamide
Names & synonyms
3-bromo-N-pyrrolidin-3-yl-benzamide1248040-30-3SCHEMBL4276758CZPCRXDUPVHYFW-UHFFFAOYSA-NAKOS011666372DB-366329
Database identifiers
- PubChem CID
- 62379878
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Related reactions
3 records
Compound notes
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