3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide

C15H17NO4S — CID 42946409

IUPAC3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(C(C)O)c1
InChIInChI=1S/C15H17NO4S/c1-11(17)12-6-5-7-13(10-12)21(18,19)16-14-8-3-4-9-15(14)20-2/h3-11,16-17H,1-2H3
InChIKeyGOMYEWMEKZWFHQ-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.55
Rot. Bonds5

About 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide

3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide (PubChem CID 42946409) has the molecular formula C15H17NO4S and a molecular weight of 307.37 g/mol. Its IUPAC name is 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide
PubChem CID42946409
Molecular FormulaC15H17NO4S
Molecular Weight307.37 g/mol
Exact Mass307.09
IUPAC Name3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(C(C)O)c1
InChIInChI=1S/C15H17NO4S/c1-11(17)12-6-5-7-13(10-12)21(18,19)16-14-8-3-4-9-15(14)20-2/h3-11,16-17H,1-2H3
InChIKeyGOMYEWMEKZWFHQ-UHFFFAOYSA-N
XLogP2.55
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

propan-2-yl 3-[(2-methoxyphenyl)sulfamoyl]benzoate
CID 35468470
N-(2,3-dichlorophenyl)-3-(1-hydroxyethyl)benzenesulfonamide
CID 43507509
N-(2,4-dichlorophenyl)-3-(1-hydroxyethyl)benzenesulfonamide
CID 43507327
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
N-(3-chloro-2-fluorophenyl)-3-(1-hydroxyethyl)benzenesulfonamide
CID 43507543
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765
N-(2-bromo-5-fluorophenyl)-3-(1-hydroxyethyl)benzenesulfonamide
CID 107629533
N-(2-methoxyphenyl)-3-nitrobenzenesulfonamide
CID 2834884
N-[2-(3-chlorophenyl)-2-hydroxyethyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 51114512
N-(2-methoxyphenyl)-3-[(2-methylbutanoylamino)carbamoyl]benzenesulfonamide
CID 24622460
3-chloro-4-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
CID 961849
3-(1-hydroxyethyl)-N-(4-iodophenyl)benzenesulfonamide
CID 43507196

Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide?
The IUPAC name of 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide (CID 42946409) is 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide is COc1ccccc1NS(=O)(=O)c1cccc(C(C)O)c1.
What is the InChIKey of 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide?
The InChIKey is GOMYEWMEKZWFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4S/c1-11(17)12-6-5-7-13(10-12)21(18,19)16-14-8-3-4-9-15(14)20-2/h3-11,16-17H,1-2H3.
What are the key properties of 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide?
3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide has a molecular weight of 307.37 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxyethyl)-N-(2-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 42946409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).