2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide

C20H19N3O4S — CID 3151770

IUPAC2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C20H19N3O4S/c1-15-6-2-3-7-18(15)27-14-20(24)22-16-9-11-17(12-10-16)28(25,26)23-19-8-4-5-13-21-19/h2-13H,14H2,1H3,(H,21,23)(H,22,24)
InChIKeyKVXCGSNMGXBUJS-UHFFFAOYSA-N
MW397.46 g/mol
LogP3.21
Rot. Bonds7

About 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide

2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide (PubChem CID 3151770) has the molecular formula C20H19N3O4S and a molecular weight of 397.46 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
PubChem CID3151770
Molecular FormulaC20H19N3O4S
Molecular Weight397.46 g/mol
Exact Mass397.11
IUPAC Name2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C20H19N3O4S/c1-15-6-2-3-7-18(15)27-14-20(24)22-16-9-11-17(12-10-16)28(25,26)23-19-8-4-5-13-21-19/h2-13H,14H2,1H3,(H,21,23)(H,22,24)
InChIKeyKVXCGSNMGXBUJS-UHFFFAOYSA-N
XLogP3.21
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.46
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide 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-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide (CID 3151770) is 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide is Cc1ccccc1OCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1.
What is the InChIKey of 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide?
The InChIKey is KVXCGSNMGXBUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4S/c1-15-6-2-3-7-18(15)27-14-20(24)22-16-9-11-17(12-10-16)28(25,26)23-19-8-4-5-13-21-19/h2-13H,14H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide?
2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide has a molecular weight of 397.46 g/mol, XLogP of 3.21, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 3151770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).