Basic information
- Standard SMILES
O=C(OC1CCN(C2CCNCC2)CC1)c1ccccc1- InChIKey
DTQLOEKHOAOJTM-UHFFFAOYSA-N- Molecular formula
- C17H24N2O2
- Average molar mass
- 288.4 g/mol
- Monoisotopic mass
- 288.18377801
Names & identifiers
- Preferred name
- Benzoic acid [1,4']bipiperidinyl-4-yl ester
- IUPAC
- (1-piperidin-4-ylpiperidin-4-yl) benzoate
Names & synonyms
SCHEMBL1085049DTQLOEKHOAOJTM-UHFFFAOYSA-Nbenzoic acid [1,4']bipiperidinyl-4-yl ester
Database identifiers
- PubChem CID
- 66901535
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 328
Related reactions
6 records
Compound notes
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