Basic information
- CAS
85868-44-6- Standard SMILES
Nc1ccccc1OCCCN1CCN(c2ccccc2)CC1- InChIKey
GETZZYGZLIMDDA-UHFFFAOYSA-N- Molecular formula
- C19H25N3O
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.19976243
Names & identifiers
- Preferred name
- Benzenamine, 2-(3-(4-phenyl-1-piperazinyl)propoxy)-
- IUPAC
- 2-[3-(4-phenylpiperazin-1-yl)propoxy]aniline
Names & synonyms
BRN 4534631BENZENAMINE, 2-(3-(4-PHENYL-1-PIPERAZINYL)PROPOXY)-2-(3-(4-Phenyl-1-piperazinyl)propoxy)benzenamine85868-44-6DTXSID10235149RefChem:322787DTXCID601576402-[3-(4-phenylpiperazin-1-yl)propoxy]aniline
Database identifiers
- CAS
85868-44-6- PubChem CID
- 55412
- DTXSID
DTXSID10235149
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 41.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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