Basic information
- Standard SMILES
OC1(c2ccccc2)CCN(CCCCn2cc(Cl)cn2)CC1- InChIKey
RGRYAKLFIRPFCR-UHFFFAOYSA-N- Molecular formula
- C18H24ClN3O
- Average molar mass
- 333.9 g/mol
Names & identifiers
- Preferred name
- 4-chloro-1-[4-(4-hydroxy-4-phenyl-1-piperidyl)butyl)-1H-pyrazole
- IUPAC
- 1-[4-(4-chloropyrazol-1-yl)butyl]-4-phenylpiperidin-4-ol
Names & synonyms
4-chloro-1-[4-(4-hydroxy-4-phenyl-1-piperidyl)butyl)-1H-pyrazole4-chloro-1-[4-(4-hydroxy-4-phenyl-1-piperidyl)butyl]-1H-pyrazoleSCHEMBL5848148RGRYAKLFIRPFCR-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 9840622
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 354
Related reactions
3 records
Compound notes
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