5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4-pentadien-1-one
Properties
- Molecular formula
- C17H19NO3
- Molar mass
- 285.34 g/mol
- Exact mass
- 285.1365 Da
- Melting point
- 129 °C
- logP
- 3.00Crippen estimate
- Polar surface area
- 38.8 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 3
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
7780-20-3SMILES
O=C(C=CC=Cc1ccc2c(c1)OCO2)N1CCCCC1InChIKey
MXXWOMGUGJBKIW-UHFFFAOYSA-NInChI
InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Piperidine, 1-[5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]-
- 2,4-Pentadien-1-one, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-
- Piperidine, 1-piperoyl-
- NSC 242267
Work with 5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4-pentadien-1-one
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
5-(1,3-Benzodioxol-5-yl)penta-2,4-dienal83047-59-053 % similar
3′,4′-Methylenedioxycinnamic acid2373-80-053 % similar
Heliotropyl acetone3160-37-050 % similar
Piperlonguminine5950-12-946 % similar
Isosafrole120-58-144 % similar
Tetrahydropiperine23434-88-044 % similar
Piperonal120-57-042 % similar
5-(2-Nitroethenyl)-1,3-benzodioxole1485-00-341 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.