2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol

C13H22F3NO — CID 79563958

IUPAC2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol
SMILESOC1CCCC1CCN1CCC(C(F)(F)F)CC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)11-5-8-17(9-6-11)7-4-10-2-1-3-12(10)18/h10-12,18H,1-9H2
InChIKeyRCGLBROQOQTGKP-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.81
Rot. Bonds3

About 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol

2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol (PubChem CID 79563958) has the molecular formula C13H22F3NO and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol
PubChem CID79563958
Molecular FormulaC13H22F3NO
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Name2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol
SMILESOC1CCCC1CCN1CCC(C(F)(F)F)CC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)11-5-8-17(9-6-11)7-4-10-2-1-3-12(10)18/h10-12,18H,1-9H2
InChIKeyRCGLBROQOQTGKP-UHFFFAOYSA-N
XLogP2.81
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol?
The IUPAC name of 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol (CID 79563958) is 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol?
The canonical SMILES for 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol is OC1CCCC1CCN1CCC(C(F)(F)F)CC1.
What is the InChIKey of 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol?
The InChIKey is RCGLBROQOQTGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3NO/c14-13(15,16)11-5-8-17(9-6-11)7-4-10-2-1-3-12(10)18/h10-12,18H,1-9H2.
What are the key properties of 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol?
2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol has a molecular weight of 265.32 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]cyclopentan-1-ol is sourced from PubChem (CID 79563958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).