2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide

C15H18N2O4S — CID 90518353

IUPAC2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide
SMILESCOc1ccc(OCCS(=O)(=O)Nc2ncccc2C)cc1
InChIInChI=1S/C15H18N2O4S/c1-12-4-3-9-16-15(12)17-22(18,19)11-10-21-14-7-5-13(20-2)6-8-14/h3-9H,10-11H2,1-2H3,(H,16,17)
InChIKeyGGNUKFWZHJIZPV-UHFFFAOYSA-N
MW322.39 g/mol
LogP2.22
Rot. Bonds7

About 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide

2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide (PubChem CID 90518353) has the molecular formula C15H18N2O4S and a molecular weight of 322.39 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide
PubChem CID90518353
Molecular FormulaC15H18N2O4S
Molecular Weight322.39 g/mol
Exact Mass322.10
IUPAC Name2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide
SMILESCOc1ccc(OCCS(=O)(=O)Nc2ncccc2C)cc1
InChIInChI=1S/C15H18N2O4S/c1-12-4-3-9-16-15(12)17-22(18,19)11-10-21-14-7-5-13(20-2)6-8-14/h3-9H,10-11H2,1-2H3,(H,16,17)
InChIKeyGGNUKFWZHJIZPV-UHFFFAOYSA-N
XLogP2.22
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide (CID 90518353) is 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide is COc1ccc(OCCS(=O)(=O)Nc2ncccc2C)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide?
The InChIKey is GGNUKFWZHJIZPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S/c1-12-4-3-9-16-15(12)17-22(18,19)11-10-21-14-7-5-13(20-2)6-8-14/h3-9H,10-11H2,1-2H3,(H,16,17).
What are the key properties of 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide?
2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide has a molecular weight of 322.39 g/mol, XLogP of 2.22, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(3-methyl-2-pyridinyl)ethanesulfonamide is sourced from PubChem (CID 90518353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).