2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol

C11H16O4S — CID 71865095

IUPAC2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol
SMILESCOc1ccccc1C(C)S(=O)(=O)CCO
InChIInChI=1S/C11H16O4S/c1-9(16(13,14)8-7-12)10-5-3-4-6-11(10)15-2/h3-6,9,12H,7-8H2,1-2H3
InChIKeyLAZWNWHCGKIGIR-UHFFFAOYSA-N
MW244.31 g/mol
LogP1.16
Rot. Bonds5

About 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol

2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol (PubChem CID 71865095) has the molecular formula C11H16O4S and a molecular weight of 244.31 g/mol. Its IUPAC name is 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol.

Molecular Properties

Compound Name2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol
PubChem CID71865095
Molecular FormulaC11H16O4S
Molecular Weight244.31 g/mol
Exact Mass244.08
IUPAC Name2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol
SMILESCOc1ccccc1C(C)S(=O)(=O)CCO
InChIInChI=1S/C11H16O4S/c1-9(16(13,14)8-7-12)10-5-3-4-6-11(10)15-2/h3-6,9,12H,7-8H2,1-2H3
InChIKeyLAZWNWHCGKIGIR-UHFFFAOYSA-N
XLogP1.16
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethylsulfonyl-1-(2-methoxyphenyl)butan-1-ol
CID 65097851
3-(2-methoxyphenyl)pentane-1,5-diol
CID 51050570
2-amino-2-(2-methoxyphenyl)ethanol
CID 10352062
methyl (2S)-2-(2-methoxyphenyl)propanoate
CID 12867082
3-[1-(2-methoxyphenyl)ethylsulfamoyl]propanoic acid
CID 43361900
2-chloro-N-[1-(2-methoxyphenyl)ethyl]ethanesulfonamide
CID 107650835
2-[3-(2-methoxyphenyl)propylsulfonyl]ethanol
CID 110018786
N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanesulfonamide
CID 28560659
1-(2-methoxyphenyl)-1-(2-methylsulfonylethylsulfanyl)propan-2-amine
CID 63660617
(1S,2R)-2-amino-1-(2-methoxyphenyl)propan-1-ol
CID 15671931
[(2R)-2-hydroxy-2-(2-methoxyphenyl)ethyl] methanesulfonate
CID 87403011
1-(2-methoxyphenyl)butane-1,2,4-triol
CID 171871923

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol?
The IUPAC name of 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol (CID 71865095) is 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol.
What is the SMILES notation for 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol?
The canonical SMILES for 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol is COc1ccccc1C(C)S(=O)(=O)CCO.
What is the InChIKey of 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol?
The InChIKey is LAZWNWHCGKIGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O4S/c1-9(16(13,14)8-7-12)10-5-3-4-6-11(10)15-2/h3-6,9,12H,7-8H2,1-2H3.
What are the key properties of 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol?
2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol has a molecular weight of 244.31 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyphenyl)ethylsulfonyl]ethanol is sourced from PubChem (CID 71865095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).