Basic information
- CAS
937598-62-4- Standard SMILES
NCc1ccc(N2CCN(c3ccc(F)cc3)CC2)cc1- InChIKey
GTKQVUIWTFYAHM-UHFFFAOYSA-N- Molecular formula
- C17H20FN3
- Average molar mass
- 285.36 g/mol
- Monoisotopic mass
- 285.16412581
Names & identifiers
- Preferred name
- 1-{4-[4-(4-Fluorophenyl)piperazin-1-YL]phenyl}methanamine
- IUPAC
- [4-[4-(4-fluorophenyl)piperazin-1-yl]phenyl]methanamine
Names & synonyms
4-[4-(4-Fluorophenyl)-1-piperazinyl]benzenemethanamineDTXSID2012099721-{4-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]PHENYL}METHANAMINEAKOS000218172937598-62-4
Database identifiers
- CAS
937598-62-4- PubChem CID
- 19627273
- DTXSID
DTXSID201209972
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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