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3-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-propen-1-one

HCID 54930
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
23434-86-8
Standard SMILES
O=C(C=Cc1ccc2c(c1)OCO2)N1CCCCC1
InChIKey
BLPUOQGPBJPXRL-UHFFFAOYSA-N
Molecular formula
C15H17NO3
Average molar mass
259.3 g/mol
Monoisotopic mass
259.1208434

Overview

N-piperidyl-3,4-methylenedioxycinnamoylamide has been reported in Piper capense, Piper nigrum, and other organisms with data available.

Names & identifiers

Preferred name
3-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-propen-1-one
IUPAC
3-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylprop-2-en-1-one

Names & synonyms

23434-86-83-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2-propen-1-oneRefChem:1066359Piperidine, 1-(3-(1,3-benzodioxol-5-yl)-1-oxo-2-propenyl)-3-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylprop-2-en-1-one3-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)prop-2-en-1-oneN-piperidyl-3,4-methylenedioxycinnamoylamideNSC 125179N-(3,4-Methylenedioxycinnamoyl)piperidinePiperidine, 1-(3,4-(methylenedioxy)cinnamoyl)-(E/Z)-ANTIEPILEPSIRINESCHEMBL3838030
Show more names
CHEMBL4303457SCHEMBL30237912DTXSID608650961-(3-(1,3-Benzodioxol-5-yl)-1-oxo-2-propenyl)piperidineAKOS017262334Q23823893

Database identifiers

CAS
23434-86-8
PubChem CID
54930
DTXSID
DTXSID60865096
ChEMBL
CHEMBL4303457

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
349

Experimental & physicochemical properties

LogP2.82

Related reactions

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Compound notes

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