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4-benzyl-N-phenylpiperazine-1-carboxamide

HCID 732307
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
65766-74-7
Standard SMILES
O=C(Nc1ccccc1)N1CCN(Cc2ccccc2)CC1
InChIKey
KPXKZXWDRQMAJJ-UHFFFAOYSA-N
Molecular formula
C18H21N3O
Average molar mass
295.4 g/mol
Monoisotopic mass
295.16846229

Names & identifiers

Preferred name
4-benzyl-N-phenylpiperazine-1-carboxamide
IUPAC
4-benzyl-N-phenylpiperazine-1-carboxamide

Names & synonyms

4-benzyl-N-phenylpiperazine-1-carboxamide65766-74-7CHEMBL16194181-Piperazinecarboxamide, N-phenyl-4-(phenylmethyl)-4-Benzyl-piperazine-1-carboxylic acid phenylamide4-benzyl-N-phenyl-1-piperazinecarboxamideCambridge id 5730361Oprea1_589291Oprea1_802506SCHEMBL3596348SCHEMBL3895913DTXSID90352681
Show more names
KPXKZXWDRQMAJJ-UHFFFAOYSA-NBDBM50394643CCG-55074AKOS000665774EBC-610291N-phenyl[4-benzylpiperazinyl]carboxamideST50277632AB00095053-01

Database identifiers

CAS
65766-74-7
PubChem CID
732307
DTXSID
DTXSID90352681
ChEMBL
CHEMBL1619418
Nikkaji
J740.552I

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
35.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
340

Related reactions

4 records
New reaction record
HRID 40621 reaction equation
HRID 40621As productuspto-grants-2013_09
HRID 96110 reaction equation
HRID 96110As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1754224 reaction equation
HRID 1754224As productuspto-grants-2015_10
HRID 1817106 reaction equation
HRID 1817106As productuspto-grants-2009_10

Compound notes

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