3-(4-Methylpiperazin-1-yl)-1-phenylpropyl propanoate
Basic information
- CAS
149848-02-2- Standard SMILES
CCC(=O)OC(CCN1CCN(C)CC1)c1ccccc1- InChIKey
VSQIPTDKWPLWEV-UHFFFAOYSA-N- Molecular formula
- C17H26N2O2
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.19942808
Names & identifiers
- Preferred name
- 3-(4-Methylpiperazin-1-yl)-1-phenylpropyl propanoate
- IUPAC
- [3-(4-methylpiperazin-1-yl)-1-phenylpropyl] propanoate
Names & synonyms
149848-02-2DTXSID309337713-(4-METHYLPIPERAZIN-1-YL)-1-PHENYLPROPYL PROPANOATERefChem:1066907DTXCID4013624274-Methyl-alpha-phenyl-1-piperazinepropanol propanoate (ester)1-Piperazinepropanol, 4-methyl-alpha-phenyl-, propanoate (ester)
Database identifiers
- CAS
149848-02-2- PubChem CID
- 3073533
- DTXSID
DTXSID30933771- Nikkaji
- J534.842K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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