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N-(3-{1-[4,4-bis(4-fluorophenyl)butyl]-4-piperidinyl}-4-methylphenyl)-2-methylpropanamide

HCID 22048974
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(NC(=O)C(C)C)cc1C1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1
InChIKey
RIGVLAWEINHPLI-UHFFFAOYSA-N
Molecular formula
C32H38F2N2O
Average molar mass
504.7 g/mol

Names & identifiers

Preferred name
N-(3-{1-[4,4-bis(4-fluorophenyl)butyl]-4-piperidinyl}-4-methylphenyl)-2-methylpropanamide
IUPAC
N-[3-[1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl]-4-methylphenyl]-2-methylpropanamide

Names & synonyms

SCHEMBL5660979RIGVLAWEINHPLI-UHFFFAOYSA-NN-(3-{1-[4,4-bis(4-fluorophenyl)butyl]-4-piperidinyl}-4-methylphenyl)-2-methylpropanamide

Database identifiers

PubChem CID
22048974

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
37
Formal charge
0
Complexity
656

Related reactions

6 records
New reaction record
HRID 188072 reaction equation
HRID 188072As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1832265 reaction equation
HRID 1832265As productuspto-grants-2006_06
HRID 1832434 reaction equation
HRID 1832434As productuspto-grants-2006_06
HRID 2087258 reaction equation
HRID 2087258As productuspto-grants-2004_04
HRID 2087425 reaction equation
HRID 2087425As productuspto-grants-2004_04
HRID 2127251 reaction equation
HRID 2127251As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes