1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol

C11H11FN2O — CID 118871174

IUPAC1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol
SMILESC[C@H](c1ccccc1F)n1cc(O)cn1
InChIInChI=1S/C11H11FN2O/c1-8(14-7-9(15)6-13-14)10-4-2-3-5-11(10)12/h2-8,15H,1H3/t8-/m1/s1
InChIKeyKSZXQIDPLUEMDN-MRVPVSSYSA-N
MW206.22 g/mol
LogP2.34
Rot. Bonds2

About 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol

1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol (PubChem CID 118871174) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol.

Molecular Properties

Compound Name1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol
PubChem CID118871174
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol
SMILESC[C@H](c1ccccc1F)n1cc(O)cn1
InChIInChI=1S/C11H11FN2O/c1-8(14-7-9(15)6-13-14)10-4-2-3-5-11(10)12/h2-8,15H,1H3/t8-/m1/s1
InChIKeyKSZXQIDPLUEMDN-MRVPVSSYSA-N
XLogP2.34
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol?
The IUPAC name of 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol (CID 118871174) is 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol.
What is the SMILES notation for 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol?
The canonical SMILES for 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol is C[C@H](c1ccccc1F)n1cc(O)cn1.
What is the InChIKey of 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol?
The InChIKey is KSZXQIDPLUEMDN-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-8(14-7-9(15)6-13-14)10-4-2-3-5-11(10)12/h2-8,15H,1H3/t8-/m1/s1.
What are the key properties of 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol?
1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol has a molecular weight of 206.22 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(2-fluorophenyl)ethyl]pyrazol-4-ol is sourced from PubChem (CID 118871174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).