5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine

C13H23F3N2 — CID 64860745

IUPAC5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine
SMILESCC1CNC(C2CCCCC2)CN1CC(F)(F)F
InChIInChI=1S/C13H23F3N2/c1-10-7-17-12(11-5-3-2-4-6-11)8-18(10)9-13(14,15)16/h10-12,17H,2-9H2,1H3
InChIKeySFYTUMDWAIORGI-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.79
Rot. Bonds2

About 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine

5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine (PubChem CID 64860745) has the molecular formula C13H23F3N2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine.

Molecular Properties

Compound Name5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine
PubChem CID64860745
Molecular FormulaC13H23F3N2
Molecular Weight264.33 g/mol
Exact Mass264.18
IUPAC Name5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine
SMILESCC1CNC(C2CCCCC2)CN1CC(F)(F)F
InChIInChI=1S/C13H23F3N2/c1-10-7-17-12(11-5-3-2-4-6-11)8-18(10)9-13(14,15)16/h10-12,17H,2-9H2,1H3
InChIKeySFYTUMDWAIORGI-UHFFFAOYSA-N
XLogP2.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclohexyl-2-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine
CID 64859620
5-cyclohexyl-1-(3-methoxypropyl)-2-methylpiperazine
CID 64860169
5-cyclohexyl-2-methyl-1-(2-methylpentyl)piperazine
CID 64860363
4-[(5-cyclohexyl-2-methylpiperazin-1-yl)methyl]-3H-1,3-thiazol-2-one
CID 106383596
2-[(5-cyclohexyl-2-methylpiperazin-1-yl)methyl]-5-methyl-1,3-oxazole
CID 106376686
5-cyclopropyl-2-methyl-1-(2-methyl-2-thiophen-2-ylpropyl)piperazine
CID 80527617
1-cyclooctyl-5-cyclopropyl-2-methylpiperazine
CID 64931171
3-[2-(5-cyclohexyl-2-methylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 106408900
5-cyclohexyl-1-(2-cyclopentylethyl)-2-ethylpiperazine
CID 64935138
2-tert-butyl-5-cyclohexyl-1-(2-methylpropyl)piperazine
CID 64859818
1-butyl-2-tert-butyl-5-cyclohexylpiperazine
CID 64859625
5-cyclohexyl-2-methyl-1-(3-methylcyclopentyl)piperazine
CID 114551124

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine?
The IUPAC name of 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine (CID 64860745) is 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine.
What is the SMILES notation for 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine?
The canonical SMILES for 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine is CC1CNC(C2CCCCC2)CN1CC(F)(F)F.
What is the InChIKey of 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine?
The InChIKey is SFYTUMDWAIORGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23F3N2/c1-10-7-17-12(11-5-3-2-4-6-11)8-18(10)9-13(14,15)16/h10-12,17H,2-9H2,1H3.
What are the key properties of 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine?
5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine has a molecular weight of 264.33 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine is sourced from PubChem (CID 64860745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).