Basic information
- CAS
101670-77-3- Standard SMILES
O=C(C1CC1c1ccccc1)N1CCC([NH2+]c2ccccc2)CC1.[Cl-]- InChIKey
TVDCSHNSMWHFOD-UHFFFAOYSA-N- Molecular formula
- C21H25ClN2O
- Average molar mass
- 356.9 g/mol
- Monoisotopic mass
- 356.1655411
Names & identifiers
- Preferred name
- (4-Anilinopiperidin-1-yl)(2-phenylcyclopropyl)methanone--hydrogen chloride (1/1)
- IUPAC
- phenyl-[1-(2-phenylcyclopropanecarbonyl)piperidin-4-yl]azanium chloride
Names & synonyms
101670-77-3DTXSID40906476(4-Anilinopiperidin-1-yl)(2-phenylcyclopropyl)methanone--hydrogen chloride (1/1)RefChem:1050392DTXCID1013355741-(trans-2-Phenylcyclopropylcarbonyl)-4-anilinopiperidine hydrochlorideKETONE, 4-ANILINOPIPERIDINO 2-PHENYLCYCLOPROPYL, HYDROCHLORIDEphenyl-[1-(2-phenylcyclopropanecarbonyl)piperidin-4-yl]azanium;chloride
Database identifiers
- CAS
101670-77-3- PubChem CID
- 58725
Properties
Computed structural properties
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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