(4-cyclopropylsulfonyl-3-fluorophenyl)methanol

C10H11FO3S — CID 84693412

IUPAC(4-cyclopropylsulfonyl-3-fluorophenyl)methanol
SMILESO=S(=O)(c1ccc(CO)cc1F)C1CC1
InChIInChI=1S/C10H11FO3S/c11-9-5-7(6-12)1-4-10(9)15(13,14)8-2-3-8/h1,4-5,8,12H,2-3,6H2
InChIKeyDZDITGLLBFJGBY-UHFFFAOYSA-N
MW230.26 g/mol
LogP1.25
Rot. Bonds3

About (4-cyclopropylsulfonyl-3-fluorophenyl)methanol

(4-cyclopropylsulfonyl-3-fluorophenyl)methanol (PubChem CID 84693412) has the molecular formula C10H11FO3S and a molecular weight of 230.26 g/mol. Its IUPAC name is (4-cyclopropylsulfonyl-3-fluorophenyl)methanol.

Molecular Properties

Compound Name(4-cyclopropylsulfonyl-3-fluorophenyl)methanol
PubChem CID84693412
Molecular FormulaC10H11FO3S
Molecular Weight230.26 g/mol
Exact Mass230.04
IUPAC Name(4-cyclopropylsulfonyl-3-fluorophenyl)methanol
SMILESO=S(=O)(c1ccc(CO)cc1F)C1CC1
InChIInChI=1S/C10H11FO3S/c11-9-5-7(6-12)1-4-10(9)15(13,14)8-2-3-8/h1,4-5,8,12H,2-3,6H2
InChIKeyDZDITGLLBFJGBY-UHFFFAOYSA-N
XLogP1.25
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethylsulfonyl-3-fluorophenyl)methanol
CID 112594378
3-[3-fluoro-4-(oxetan-3-ylsulfonyl)phenyl]propan-1-ol
CID 117438220
N-cycloheptyl-2-fluoro-4-(hydroxymethyl)-N-methylbenzenesulfonamide
CID 79178549
[4-(2,5-dimethylpiperidin-1-yl)sulfonyl-3-fluorophenyl]methanol
CID 79187737
N-cyclopropyl-2-fluoro-4-(hydroxymethyl)-N-(2-methylpropyl)benzenesulfonamide
CID 79187802
2-fluoro-4-(hydroxymethyl)-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 79178367
[4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)-3-fluorophenyl]methanol
CID 79935876
2-fluoro-4-(hydroxymethyl)-N-methyl-N-propan-2-ylbenzenesulfonamide
CID 79187726
2-fluoro-4-(hydroxymethyl)-N-(4-methylsulfanylcyclohexyl)benzenesulfonamide
CID 106000991
2-fluoro-4-(hydroxymethyl)-N-methyl-N-(3-methylcyclohexyl)benzenesulfonamide
CID 79178566
[4-(2,3-dimethylpiperidin-1-yl)sulfonyl-3-fluorophenyl]methanol
CID 79186814
2-fluoro-4-(hydroxymethyl)-N-[(3-methylcyclopentyl)methyl]benzenesulfonamide
CID 106000293

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylsulfonyl-3-fluorophenyl)methanol?
The IUPAC name of (4-cyclopropylsulfonyl-3-fluorophenyl)methanol (CID 84693412) is (4-cyclopropylsulfonyl-3-fluorophenyl)methanol.
What is the SMILES notation for (4-cyclopropylsulfonyl-3-fluorophenyl)methanol?
The canonical SMILES for (4-cyclopropylsulfonyl-3-fluorophenyl)methanol is O=S(=O)(c1ccc(CO)cc1F)C1CC1.
What is the InChIKey of (4-cyclopropylsulfonyl-3-fluorophenyl)methanol?
The InChIKey is DZDITGLLBFJGBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO3S/c11-9-5-7(6-12)1-4-10(9)15(13,14)8-2-3-8/h1,4-5,8,12H,2-3,6H2.
What are the key properties of (4-cyclopropylsulfonyl-3-fluorophenyl)methanol?
(4-cyclopropylsulfonyl-3-fluorophenyl)methanol has a molecular weight of 230.26 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylsulfonyl-3-fluorophenyl)methanol is sourced from PubChem (CID 84693412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).