trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol

C11H21FN2O — CID 126846561

IUPACtrans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol
SMILESO[C@@H]1CCC[C@H]1N1CCN(CCF)CC1
InChIInChI=1S/C11H21FN2O/c12-4-5-13-6-8-14(9-7-13)10-2-1-3-11(10)15/h10-11,15H,1-9H2/t10-,11-/m1/s1
InChIKeySJSGSWZLPHUDPX-GHMZBOCLSA-N
MW216.30 g/mol
LogP0.49
Rot. Bonds3

About trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol

trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol (PubChem CID 126846561) has the molecular formula C11H21FN2O and a molecular weight of 216.30 g/mol. Its IUPAC name is trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol
PubChem CID126846561
Molecular FormulaC11H21FN2O
Molecular Weight216.30 g/mol
Exact Mass216.16
IUPAC Nametrans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol
SMILESO[C@@H]1CCC[C@H]1N1CCN(CCF)CC1
InChIInChI=1S/C11H21FN2O/c12-4-5-13-6-8-14(9-7-13)10-2-1-3-11(10)15/h10-11,15H,1-9H2/t10-,11-/m1/s1
InChIKeySJSGSWZLPHUDPX-GHMZBOCLSA-N
XLogP0.49
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.30
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol (CID 126846561) is trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol is O[C@@H]1CCC[C@H]1N1CCN(CCF)CC1.
What is the InChIKey of trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol?
The InChIKey is SJSGSWZLPHUDPX-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H21FN2O/c12-4-5-13-6-8-14(9-7-13)10-2-1-3-11(10)15/h10-11,15H,1-9H2/t10-,11-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol?
trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol has a molecular weight of 216.30 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[4-(2-fluoroethyl)piperazin-1-yl]cyclopentan-1-ol is sourced from PubChem (CID 126846561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).