2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol

C11H11FN2O — CID 91409048

IUPAC2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol
SMILESOCCn1nccc1-c1ccccc1F
InChIInChI=1S/C11H11FN2O/c12-10-4-2-1-3-9(10)11-5-6-13-14(11)7-8-15/h1-6,15H,7-8H2
InChIKeyWEHWDMLSJCEGLY-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.68
Rot. Bonds3

About 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol

2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol (PubChem CID 91409048) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol
PubChem CID91409048
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol
SMILESOCCn1nccc1-c1ccccc1F
InChIInChI=1S/C11H11FN2O/c12-10-4-2-1-3-9(10)11-5-6-13-14(11)7-8-15/h1-6,15H,7-8H2
InChIKeyWEHWDMLSJCEGLY-UHFFFAOYSA-N
XLogP1.68
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol?
The IUPAC name of 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol (CID 91409048) is 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol is OCCn1nccc1-c1ccccc1F.
What is the InChIKey of 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol?
The InChIKey is WEHWDMLSJCEGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c12-10-4-2-1-3-9(10)11-5-6-13-14(11)7-8-15/h1-6,15H,7-8H2.
What are the key properties of 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol?
2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol has a molecular weight of 206.22 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-fluorophenyl)pyrazol-1-yl]ethanol is sourced from PubChem (CID 91409048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).