Basic information
- CAS
499134-36-0- Standard SMILES
CN1CCN(C(=O)COc2ccc(F)cc2)CC1- InChIKey
IYLQQVZQWRJIRO-UHFFFAOYSA-N- Molecular formula
- C13H17FN2O2
- Average molar mass
- 252.28 g/mol
- Monoisotopic mass
- 252.12740595
Names & identifiers
- Preferred name
- 2-(4-Fluorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
- IUPAC
- 2-(4-fluorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone
- English name
- 4-fluorophenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl ether
- Molecular formula
- C13H17FN2O2
- Molecular weight
- 252.2846832
Names & synonyms
499134-36-02-(4-fluorophenoxy)-1-(4-methylpiperazin-1-yl)ethanone2-(4-Fluorophenoxy)-1-(4-methyl-1-piperazinyl)ethanoneSCHEMBL151348084-fluorophenyl 2-(4-methyl-1-piperazinyl)-2-oxoethyl etherSTK006072AKOS000650117AO-365/41272883
Database identifiers
- CAS
499134-36-0- PubChem CID
- 769257
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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