2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine

C14H24F3N — CID 106779703

IUPAC2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine
SMILESCCC1CCCC(C2NCCCC2C(F)(F)F)C1
InChIInChI=1S/C14H24F3N/c1-2-10-5-3-6-11(9-10)13-12(14(15,16)17)7-4-8-18-13/h10-13,18H,2-9H2,1H3
InChIKeyGUXPGHVCECRPCA-UHFFFAOYSA-N
MW263.35 g/mol
LogP4.13
Rot. Bonds2

About 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine

2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine (PubChem CID 106779703) has the molecular formula C14H24F3N and a molecular weight of 263.35 g/mol. Its IUPAC name is 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine
PubChem CID106779703
Molecular FormulaC14H24F3N
Molecular Weight263.35 g/mol
Exact Mass263.19
IUPAC Name2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine
SMILESCCC1CCCC(C2NCCCC2C(F)(F)F)C1
InChIInChI=1S/C14H24F3N/c1-2-10-5-3-6-11(9-10)13-12(14(15,16)17)7-4-8-18-13/h10-13,18H,2-9H2,1H3
InChIKeyGUXPGHVCECRPCA-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.35
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The IUPAC name of 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine (CID 106779703) is 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine.
What is the SMILES notation for 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The canonical SMILES for 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine is CCC1CCCC(C2NCCCC2C(F)(F)F)C1.
What is the InChIKey of 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine?
The InChIKey is GUXPGHVCECRPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3N/c1-2-10-5-3-6-11(9-10)13-12(14(15,16)17)7-4-8-18-13/h10-13,18H,2-9H2,1H3.
What are the key properties of 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine?
2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine has a molecular weight of 263.35 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylcyclohexyl)-3-(trifluoromethyl)piperidine is sourced from PubChem (CID 106779703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).