2-phenyl-4-(trifluoromethyl)piperidine

C12H14F3N — CID 66330695

IUPAC2-phenyl-4-(trifluoromethyl)piperidine
SMILESFC(F)(F)C1CCNC(c2ccccc2)C1
InChIInChI=1S/C12H14F3N/c13-12(14,15)10-6-7-16-11(8-10)9-4-2-1-3-5-9/h1-5,10-11,16H,6-8H2
InChIKeyDCTXCAIXPITDGY-UHFFFAOYSA-N
MW229.25 g/mol
LogP3.29
Rot. Bonds1

About 2-phenyl-4-(trifluoromethyl)piperidine

2-phenyl-4-(trifluoromethyl)piperidine (PubChem CID 66330695) has the molecular formula C12H14F3N and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-phenyl-4-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-phenyl-4-(trifluoromethyl)piperidine
PubChem CID66330695
Molecular FormulaC12H14F3N
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name2-phenyl-4-(trifluoromethyl)piperidine
SMILESFC(F)(F)C1CCNC(c2ccccc2)C1
InChIInChI=1S/C12H14F3N/c13-12(14,15)10-6-7-16-11(8-10)9-4-2-1-3-5-9/h1-5,10-11,16H,6-8H2
InChIKeyDCTXCAIXPITDGY-UHFFFAOYSA-N
XLogP3.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(trifluoromethyl)piperidine?
The IUPAC name of 2-phenyl-4-(trifluoromethyl)piperidine (CID 66330695) is 2-phenyl-4-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-phenyl-4-(trifluoromethyl)piperidine?
The canonical SMILES for 2-phenyl-4-(trifluoromethyl)piperidine is FC(F)(F)C1CCNC(c2ccccc2)C1.
What is the InChIKey of 2-phenyl-4-(trifluoromethyl)piperidine?
The InChIKey is DCTXCAIXPITDGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3N/c13-12(14,15)10-6-7-16-11(8-10)9-4-2-1-3-5-9/h1-5,10-11,16H,6-8H2.
What are the key properties of 2-phenyl-4-(trifluoromethyl)piperidine?
2-phenyl-4-(trifluoromethyl)piperidine has a molecular weight of 229.25 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(trifluoromethyl)piperidine is sourced from PubChem (CID 66330695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).