1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine

C13H22F3N — CID 162577100

IUPAC1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine
SMILESCC1CCCC(C(F)(F)F)N1C1CCCCC1
InChIInChI=1S/C13H22F3N/c1-10-6-5-9-12(13(14,15)16)17(10)11-7-3-2-4-8-11/h10-12H,2-9H2,1H3
InChIKeyAEQNNIAKTCEOCY-UHFFFAOYSA-N
MW249.32 g/mol
LogP4.12
Rot. Bonds1

About 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine

1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine (PubChem CID 162577100) has the molecular formula C13H22F3N and a molecular weight of 249.32 g/mol. Its IUPAC name is 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine
PubChem CID162577100
Molecular FormulaC13H22F3N
Molecular Weight249.32 g/mol
Exact Mass249.17
IUPAC Name1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine
SMILESCC1CCCC(C(F)(F)F)N1C1CCCCC1
InChIInChI=1S/C13H22F3N/c1-10-6-5-9-12(13(14,15)16)17(10)11-7-3-2-4-8-11/h10-12H,2-9H2,1H3
InChIKeyAEQNNIAKTCEOCY-UHFFFAOYSA-N
XLogP4.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine?
The IUPAC name of 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine (CID 162577100) is 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine.
What is the SMILES notation for 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine?
The canonical SMILES for 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine is CC1CCCC(C(F)(F)F)N1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine?
The InChIKey is AEQNNIAKTCEOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3N/c1-10-6-5-9-12(13(14,15)16)17(10)11-7-3-2-4-8-11/h10-12H,2-9H2,1H3.
What are the key properties of 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine?
1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine has a molecular weight of 249.32 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-methyl-6-(trifluoromethyl)piperidine is sourced from PubChem (CID 162577100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).