Basic information
- CAS
21484-34-4- Standard SMILES
Cl.O=C(CCN1CCCCC1)c1nn(-c2ccccc2)c2c1CCC2- InChIKey
RVSXRNHWGRTLFT-UHFFFAOYSA-N- Molecular formula
- C20H26ClN3O
- Average molar mass
- 359.9 g/mol
- Monoisotopic mass
- 359.1764402
Names & identifiers
- Preferred name
- 1-Propanone, 1-(1,4,5,6-tetrahydro-1-phenyl-3-cyclopentapyrazolyl)-3-piperidino-, monohydrochloride
- IUPAC
- 1-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)-3-piperidin-1-ylpropan-1-one;hydrochloride
Names & synonyms
Poli 5521484-34-41-Propanone, 1-(1,4,5,6-tetrahydro-1-phenyl-3-cyclopentapyrazolyl)-3-piperidino-, monohydrochlorideDTXSID401757661-(1,4,5,6-Tetrahydro-1-phenyl-3-cyclopentapyrazolyl)-3-piperidino-1-propanone hydrochloride3-Piperidino-1-(1,4,5,6-tetrahydro-1-phenyl-3-cyclopentapyrazolyl)-1-propanone hydrochlorideRefChem:234728DTXCID60982571-(1-Phenyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-3-(piperidin-1-yl)propan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
21484-34-4- PubChem CID
- 210653
- DTXSID
DTXSID40175766
Properties
Computed structural properties
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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