Basic information
- CAS
93778-14-4- Standard SMILES
CCOc1ccc(N2CC(C(=O)N3CCNCC3)CC2=O)cc1- InChIKey
XLMRKHPACLFOLT-UHFFFAOYSA-N- Molecular formula
- C17H23N3O3
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.1739416
Names & identifiers
- Preferred name
- 1-((1-(4-Ethoxyphenyl)-5-oxo-3-pyrrolidinyl)carbonyl)piperazine
- IUPAC
- 1-(4-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
- English name
- 1-[[1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]carbonyl]piperazine
- Molecular formula
- C17H23N3O3
- Molecular weight
- 317.38282
Names & synonyms
EINECS 298-148-693778-14-41-((1-(4-Ethoxyphenyl)-5-oxo-3-pyrrolidinyl)carbonyl)piperazine1-(4-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-oneDTXSID90918029XLMRKHPACLFOLT-UHFFFAOYSA-NNS000647651-[[1-(4-Ethoxyphenyl)-5-oxopyrrolidin-3-yl]carbonyl]piperazine1-[[1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]carbonyl]piperazine
Database identifiers
- CAS
93778-14-4- PubChem CID
- 217129
- DTXSID
DTXSID90918029- EC Number
- 298-148-6
- Nikkaji
- J348.729F
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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