2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol

C12H21F3N2O — CID 55142322

IUPAC2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)9-17-6-4-16(5-7-17)8-10-2-1-3-11(10)18/h10-11,18H,1-9H2
InChIKeyOVFNLFWKCFAITF-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.33
Rot. Bonds3

About 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol

2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol (PubChem CID 55142322) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol
PubChem CID55142322
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC Name2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)9-17-6-4-16(5-7-17)8-10-2-1-3-11(10)18/h10-11,18H,1-9H2
InChIKeyOVFNLFWKCFAITF-UHFFFAOYSA-N
XLogP1.33
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[Propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62609043
2-[[Methyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62609554
2-[[Ethyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62609558
2-[[Propyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62609563
[1-[[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]methyl]cyclopentyl]methanol
CID 62967738
2-[[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]methyl]cyclohexan-1-ol
CID 62967739
2-[[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]methyl]cycloheptan-1-ol
CID 62967743
[1-[[4-(Trifluoromethyl)piperidin-1-yl]methyl]cyclopentyl]methanol
CID 65531084
2-[[4-(Trifluoromethyl)piperidin-1-yl]methyl]cyclopentan-1-ol
CID 65531276
[1-[[3-(Trifluoromethyl)piperidin-1-yl]methyl]cyclopentyl]methanol
CID 65531856
2-[[3-(Trifluoromethyl)piperidin-1-yl]methyl]cyclopentan-1-ol
CID 65531857
2-[[Methyl(3,3,3-trifluoropropyl)amino]methyl]cyclopentan-1-ol
CID 65532627

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol (CID 55142322) is 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol is OC1CCCC1CN1CCN(CC(F)(F)F)CC1.
What is the InChIKey of 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol?
The InChIKey is OVFNLFWKCFAITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c13-12(14,15)9-17-6-4-16(5-7-17)8-10-2-1-3-11(10)18/h10-11,18H,1-9H2.
What are the key properties of 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol?
2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol has a molecular weight of 266.31 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]cyclopentan-1-ol is sourced from PubChem (CID 55142322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).