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N-[3-[1-[3-(3,4-dichlorophenoxy)-3-phenylpropyl]piperidin-4-yl]phenyl]-2-methylpropanamide (HCID 22048848)|Huagongshe
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Compound
N-[3-[1-[3-(3,4-dichlorophenoxy)-3-phenylpropyl]piperidin-4-yl]phenyl]-2-methylpropanamide
HCID
22048848
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CC(C)C(=O)Nc1cccc(C2CCN(CCC(Oc3ccc(Cl)c(Cl)c3)c3ccccc3)CC2)c1
InChIKey
FLXBVRQUDUTGTL-UHFFFAOYSA-N
Molecular formula
C30H34Cl2N2O2
Average molar mass
525.5 g/mol
Names & identifiers
Preferred name
N-[3-[1-[3-(3,4-dichlorophenoxy)-3-phenylpropyl]piperidin-4-yl]phenyl]-2-methylpropanamide
IUPAC
N-[3-[1-[3-(3,4-dichlorophenoxy)-3-phenylpropyl]piperidin-4-yl]phenyl]-2-methylpropanamide
Database identifiers
PubChem CID
22048848
Properties
Computed structural properties
XLogP
7.5
Topological polar surface area
41.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
36
Formal charge
0
Complexity
663
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
2320413
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID
2347799
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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