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Basic information
- Standard SMILES
CCOC(=O)c1cc(N2CCNCC2)cc(C(=O)OCC)n1- InChIKey
WVYGPHQOKBJYGB-UHFFFAOYSA-N- Molecular formula
- C15H21N3O4
- Average molar mass
- 307.34 g/mol
- Monoisotopic mass
- 307.15320616
Names & identifiers
- Preferred name
- Diethyl-4-piperazinyl-2,6-pyridinedicarboxylate
- IUPAC
- diethyl 4-piperazin-1-ylpyridine-2,6-dicarboxylate
Names & synonyms
SCHEMBL17595153WVYGPHQOKBJYGB-UHFFFAOYSA-NDiethyl-4-piperazinyl-2,6-pyridinedicarboxylate
Database identifiers
- PubChem CID
- 85702736
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 80.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 359
Related reactions
12 records
Compound notes
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