[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol

C11H11FN2O3S — CID 165472365

IUPAC[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol
SMILESCS(=O)(=O)c1cnn(-c2ccc(F)cc2CO)c1
InChIInChI=1S/C11H11FN2O3S/c1-18(16,17)10-5-13-14(6-10)11-3-2-9(12)4-8(11)7-15/h2-6,15H,7H2,1H3
InChIKeyFWUJSGKTSCOSNR-UHFFFAOYSA-N
MW270.28 g/mol
LogP0.91
Rot. Bonds3

About [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol

[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol (PubChem CID 165472365) has the molecular formula C11H11FN2O3S and a molecular weight of 270.28 g/mol. Its IUPAC name is [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol.

Molecular Properties

Compound Name[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol
PubChem CID165472365
Molecular FormulaC11H11FN2O3S
Molecular Weight270.28 g/mol
Exact Mass270.05
IUPAC Name[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol
SMILESCS(=O)(=O)c1cnn(-c2ccc(F)cc2CO)c1
InChIInChI=1S/C11H11FN2O3S/c1-18(16,17)10-5-13-14(6-10)11-3-2-9(12)4-8(11)7-15/h2-6,15H,7H2,1H3
InChIKeyFWUJSGKTSCOSNR-UHFFFAOYSA-N
XLogP0.91
TPSA72.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]ethanol
CID 165479610
[3-chloro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol
CID 165479622
4-fluoro-2-[(4-methylsulfonylpyrazol-1-yl)methyl]aniline
CID 165472918
1-(2,4-difluorophenyl)pyrazole-4-sulfonyl chloride
CID 43531743
1-[3-fluoro-4-(4-methylsulfonylpyrazol-1-yl)phenyl]ethanamine
CID 165477513
3-amino-4-(4-methylsulfonylpyrazol-1-yl)benzamide
CID 165472831
[3-chloro-6-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanol
CID 165480660
[3-(4-methylsulfonylpyrazol-1-yl)-2-pyridinyl]methanamine
CID 165480871
1-[4-fluoro-2-[(2-methylpropylamino)methyl]phenyl]pyrazole-4-carboxamide
CID 64781223
1-[2-(4-fluorophenyl)sulfonylethyl]-4-methylsulfonylpyrazole
CID 138020578
3-fluoro-2-(4-methylsulfonylpyrazol-1-yl)pyridine-4-carboxylic acid
CID 165472351
N-[[2-(4-chloropyrazol-1-yl)-5-fluorophenyl]methyl]propan-2-amine
CID 54910009

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol?
The IUPAC name of [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol (CID 165472365) is [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol.
What is the SMILES notation for [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol?
The canonical SMILES for [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol is CS(=O)(=O)c1cnn(-c2ccc(F)cc2CO)c1.
What is the InChIKey of [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol?
The InChIKey is FWUJSGKTSCOSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O3S/c1-18(16,17)10-5-13-14(6-10)11-3-2-9(12)4-8(11)7-15/h2-6,15H,7H2,1H3.
What are the key properties of [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol?
[5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol has a molecular weight of 270.28 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-(4-methylsulfonylpyrazol-1-yl)phenyl]methanol is sourced from PubChem (CID 165472365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).