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1-(4-Benzyl-2-methylpiperazin-1-yl)ethanone

HCID 21701656
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Basic information

Standard SMILES
CC(=O)N1CCN(Cc2ccccc2)CC1C
InChIKey
XIVQJMKMRHMYBZ-UHFFFAOYSA-N
Molecular formula
C14H20N2O
Average molar mass
232.32 g/mol
Monoisotopic mass
232.15756327

Names & identifiers

Preferred name
1-(4-Benzyl-2-methylpiperazin-1-yl)ethanone
IUPAC
1-(4-benzyl-2-methylpiperazin-1-yl)ethanone

Names & synonyms

SCHEMBL7972235

Database identifiers

PubChem CID
21701656

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
23.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
261

Related reactions

2 records
New reaction record
HRID 321888 reaction equation
HRID 321888As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 834460 reaction equation
HRID 834460As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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