2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine

C14H24F3N — CID 106779481

IUPAC2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine
SMILESCC1CC(C)CC(C2NCCCC2C(F)(F)F)C1
InChIInChI=1S/C14H24F3N/c1-9-6-10(2)8-11(7-9)13-12(14(15,16)17)4-3-5-18-13/h9-13,18H,3-8H2,1-2H3
InChIKeyGAPZPDODTSSMNS-UHFFFAOYSA-N
MW263.35 g/mol
LogP3.99
Rot. Bonds1

About 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine

2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine (PubChem CID 106779481) has the molecular formula C14H24F3N and a molecular weight of 263.35 g/mol. Its IUPAC name is 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine
PubChem CID106779481
Molecular FormulaC14H24F3N
Molecular Weight263.35 g/mol
Exact Mass263.19
IUPAC Name2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine
SMILESCC1CC(C)CC(C2NCCCC2C(F)(F)F)C1
InChIInChI=1S/C14H24F3N/c1-9-6-10(2)8-11(7-9)13-12(14(15,16)17)4-3-5-18-13/h9-13,18H,3-8H2,1-2H3
InChIKeyGAPZPDODTSSMNS-UHFFFAOYSA-N
XLogP3.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.35
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The IUPAC name of 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine (CID 106779481) is 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The canonical SMILES for 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine is CC1CC(C)CC(C2NCCCC2C(F)(F)F)C1.
What is the InChIKey of 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The InChIKey is GAPZPDODTSSMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3N/c1-9-6-10(2)8-11(7-9)13-12(14(15,16)17)4-3-5-18-13/h9-13,18H,3-8H2,1-2H3.
What are the key properties of 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine?
2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine has a molecular weight of 263.35 g/mol, XLogP of 3.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylcyclohexyl)-3-(trifluoromethyl)piperidine is sourced from PubChem (CID 106779481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).