Basic information
- Standard SMILES
COC(=O)c1cc(OC)cc(C(=O)NC2CCNCC2)c1- InChIKey
QKLQQUYMOAJAAG-UHFFFAOYSA-N- Molecular formula
- C15H20N2O4
- Average molar mass
- 292.33 g/mol
- Monoisotopic mass
- 292.14230712
Names & identifiers
- Preferred name
- 5-methoxy-N-piperidin-4-yl-isophthalamic acid methyl ester
- IUPAC
- methyl 3-methoxy-5-(piperidin-4-ylcarbamoyl)benzoate
Names & synonyms
SCHEMBL2957973QKLQQUYMOAJAAG-UHFFFAOYSA-N5-methoxy-N-piperidin-4-yl-isophthalamic acid methyl ester
Database identifiers
- PubChem CID
- 68456989
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 369
Related reactions
2 records
Compound notes
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