4-Methyl-N-(3-(trifluoromethyl)phenyl)-1-piperidinecarboxamide
Basic information
- CAS
60464-95-1- Standard SMILES
CC1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1- InChIKey
WDGIBEQSJQSBMQ-UHFFFAOYSA-N- Molecular formula
- C14H17F3N2O
- Average molar mass
- 286.29 g/mol
- Monoisotopic mass
- 286.12929766
Names & identifiers
- Preferred name
- 4-Methyl-N-(3-(trifluoromethyl)phenyl)-1-piperidinecarboxamide
- IUPAC
- 4-methyl-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
- English name
- 4-Methyl-piperidine-1-carboxylic acid (3-trifluoromethyl-phenyl)-amide
- Molecular formula
- C14H17F3N2O
- Molecular weight
- 286.29
Names & synonyms
4-methyl-N-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide4-Methyl-N-(3-(trifluoromethyl)phenyl)-1-piperidinecarboxamideRefChem:525474688-745-360464-95-1ST50544591NSC213941DTXSID70309719WDGIBEQSJQSBMQ-UHFFFAOYSA-N4-methyl-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamideAKOS002960732NSC-213941
Show more names
4-METHYL-1-(N-(3-TRIFLUOROMETHYLPHENYL)CARBAMOYL)PIPERIDINE1-Piperidinecarboxamide, 4-methyl-N-[3-(trifluoromethyl)phenyl]-4-Methyl-piperidine-1-carboxylic acid (3-trifluoromethyl-phenyl)-amide
(4-methylpiperidyl)-N-[3-(trifluoromethyl)phenyl]carboxamide
Database identifiers
- CAS
60464-95-1- PubChem CID
- 310458
- DTXSID
DTXSID70309719- EC Number
- 688-745-3
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Physicochemical properties
- Boiling point
- 396.2 · 396.2±42.0 °C(Predicted)
- Density
- 1.246 · 1.246±0.06 g/cm3(Predicted)
- pka
- 13.6 · 13.60±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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