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1-(4-Fluorophenyl)-2-methyl-2-(4-methylpiperazino)-propan-1-one

HCID 19879482
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN1CCN(C(C)(C)C(=O)c2ccc(F)cc2)CC1
InChIKey
IWXHAKVCMNRBCK-UHFFFAOYSA-N
Molecular formula
C15H21FN2O
Average molar mass
264.34 g/mol

Names & identifiers

Preferred name
1-(4-Fluorophenyl)-2-methyl-2-(4-methylpiperazino)-propan-1-one
IUPAC
1-(4-fluorophenyl)-2-methyl-2-(4-methylpiperazin-1-yl)propan-1-one

Names & synonyms

SCHEMBL9679862IWXHAKVCMNRBCK-UHFFFAOYSA-N1-(4-Fluorophenyl)-2-methyl-2-(4-methylpiperazino)-propan-1-one

Database identifiers

PubChem CID
19879482

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
23.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
316

Related reactions

6 records
New reaction record
HRID 184078 reaction equation
HRID 184078As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 672580 reaction equation
HRID 672580As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 981751 reaction equation
HRID 981751As productuspto-grants-1991_02
HRID 981752 reaction equation
HRID 981752As reactantuspto-grants-1991_02
HRID 1885646 reaction equation
HRID 1885646As productuspto-grants-1992_09
HRID 1885647 reaction equation
HRID 1885647As reactantuspto-grants-1992_09

Compound notes

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