Basic information
- Standard SMILES
CN(C)C1CCN(Cc2ccc(C(=O)O)cc2)C1- InChIKey
ONFFLUYJGXJQPG-UHFFFAOYSA-N- Molecular formula
- C14H20N2O2
- Average molar mass
- 248.32 g/mol
Names & identifiers
- Preferred name
- 4-[[3-(Dimethylamino)pyrrolidin-1-yl]methyl]benzoic acid
- IUPAC
- 4-[[3-(dimethylamino)pyrrolidin-1-yl]methyl]benzoic acid
Names & synonyms
SCHEMBL4578108AKOS012465848
Database identifiers
- PubChem CID
- 63164286
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 286
Related reactions
4 records
Compound notes
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