(2-cyclobutylsulfonylphenyl)methanol

C11H14O3S — CID 84690547

IUPAC(2-cyclobutylsulfonylphenyl)methanol
SMILESO=S(=O)(c1ccccc1CO)C1CCC1
InChIInChI=1S/C11H14O3S/c12-8-9-4-1-2-7-11(9)15(13,14)10-5-3-6-10/h1-2,4,7,10,12H,3,5-6,8H2
InChIKeyMRLFIPJABKWJIZ-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.51
Rot. Bonds3

About (2-cyclobutylsulfonylphenyl)methanol

(2-cyclobutylsulfonylphenyl)methanol (PubChem CID 84690547) has the molecular formula C11H14O3S and a molecular weight of 226.30 g/mol. Its IUPAC name is (2-cyclobutylsulfonylphenyl)methanol.

Molecular Properties

Compound Name(2-cyclobutylsulfonylphenyl)methanol
PubChem CID84690547
Molecular FormulaC11H14O3S
Molecular Weight226.30 g/mol
Exact Mass226.07
IUPAC Name(2-cyclobutylsulfonylphenyl)methanol
SMILESO=S(=O)(c1ccccc1CO)C1CCC1
InChIInChI=1S/C11H14O3S/c12-8-9-4-1-2-7-11(9)15(13,14)10-5-3-6-10/h1-2,4,7,10,12H,3,5-6,8H2
InChIKeyMRLFIPJABKWJIZ-UHFFFAOYSA-N
XLogP1.51
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-cyclobutylsulfonylphenyl)propanoic acid
CID 117424665
N-(cyclobutylmethyl)-N-ethyl-2-(hydroxymethyl)benzenesulfonamide
CID 107402685
2-amino-1-(2-cyclobutylsulfonylphenyl)ethanol
CID 117391624
3-amino-1-(2-cyclobutylsulfonylphenyl)propan-1-one
CID 117421840
1-(2-cyclopropylsulfonylphenyl)-N-methoxymethanamine
CID 117355562
2-(2-cyclobutylsulfonylphenyl)-2-hydroxyacetic acid
CID 117428997
[1-(2-cyclobutylsulfonylphenyl)cyclopropyl]methanamine
CID 117417974
[2-(aminosulfonimidoyl)phenyl]methanol
CID 151851038
2-(hydroxymethyl)-N-methyl-N-(2-methyloxolan-3-yl)benzenesulfonamide
CID 82745252
2-cyclopropylsulfonylbenzaldehyde
CID 84677789
1-(2-cyclobutylsulfonylphenyl)cyclohexan-1-amine
CID 117473650
[2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)phenyl]methanol
CID 79937246

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutylsulfonylphenyl)methanol?
The IUPAC name of (2-cyclobutylsulfonylphenyl)methanol (CID 84690547) is (2-cyclobutylsulfonylphenyl)methanol.
What is the SMILES notation for (2-cyclobutylsulfonylphenyl)methanol?
The canonical SMILES for (2-cyclobutylsulfonylphenyl)methanol is O=S(=O)(c1ccccc1CO)C1CCC1.
What is the InChIKey of (2-cyclobutylsulfonylphenyl)methanol?
The InChIKey is MRLFIPJABKWJIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3S/c12-8-9-4-1-2-7-11(9)15(13,14)10-5-3-6-10/h1-2,4,7,10,12H,3,5-6,8H2.
What are the key properties of (2-cyclobutylsulfonylphenyl)methanol?
(2-cyclobutylsulfonylphenyl)methanol has a molecular weight of 226.30 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutylsulfonylphenyl)methanol is sourced from PubChem (CID 84690547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).