Basic information
- Standard SMILES
CCOC(=O)C(c1cccnc1)N1CCN(C)CC1- InChIKey
SBJPODTYGMXFSA-UHFFFAOYSA-N- Molecular formula
- C14H21N3O2
- Average molar mass
- 263.34 g/mol
Names & identifiers
- Preferred name
- (4-Methyl-piperazin-1-yl)-pyridin-3-yl-acetic acid ethyl ester
- IUPAC
- ethyl 2-(4-methylpiperazin-1-yl)-2-pyridin-3-ylacetate
Names & synonyms
SCHEMBL6640205SBJPODTYGMXFSA-UHFFFAOYSA-N(4-methyl-piperazin-1-yl)-pyridin-3-yl-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 69848839
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 45.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 290
Related reactions
2 records
Compound notes
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