Want to comment
on this record?

1-{3-[(3,4-Dimethylphenyl)amino]-1-piperidinyl}-4,4,4-trifluoro-1-butanone

ChemSpider ID: 22176228
Molecular Formula: C₁₇H₂₃F₃N₂O
Average mass: 328.372498 Da
Monoisotopic mass: 328.176239 Da
Systematic name

1-{3-[(3,4-Dimethylphenyl)amino]-1-piperidinyl}-4,4,4-trifluoro-1-butanone
SMILES and InChIs

SMILES:

Cc1ccc(cc1C)NC2CCCN(C2)C(=O)CCC(F)(F)F Copied

Std. InChI:

InChI=1S/C17H23F3N2O/c1-12-5-6-14(10-13(12)2)21-15-4-3-9-22(11-15)16(23)7-8-17(18,19)20/h5-6,10,15,21H,3-4,7-9,11H2,1-2H3 Copied

Std. InChIKey:

ULQSSQZQRAOGPI-UHFFFAOYSA-N Copied
Cite this record
CSID:22176228, http://www.chemspider.com/Chemical-Structure.22176228.html (accessed 10:45, May 25, 2012) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

N-(3,4-dimethylphenyl)-1-(4,4,4-trifluorobutanoyl)-3-piperidinamine

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library

Advertise Sponsor