4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide

C19H24N2O5S — CID 17353518

IUPAC4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
SMILESCOCCOc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O5S/c1-14(2)21-27(23,24)18-10-6-16(7-11-18)20-19(22)15-4-8-17(9-5-15)26-13-12-25-3/h4-11,14,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyXDQVSVOFSLMBAF-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.65
Rot. Bonds9

About 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide

4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 17353518) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
PubChem CID17353518
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC Name4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
SMILESCOCCOc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O5S/c1-14(2)21-27(23,24)18-10-6-16(7-11-18)20-19(22)15-4-8-17(9-5-15)26-13-12-25-3/h4-11,14,21H,12-13H2,1-3H3,(H,20,22)
InChIKeyXDQVSVOFSLMBAF-UHFFFAOYSA-N
XLogP2.65
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide 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 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide (CID 17353518) is 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide is COCCOc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)cc1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is XDQVSVOFSLMBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-14(2)21-27(23,24)18-10-6-16(7-11-18)20-19(22)15-4-8-17(9-5-15)26-13-12-25-3/h4-11,14,21H,12-13H2,1-3H3,(H,20,22).
What are the key properties of 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 392.48 g/mol, XLogP of 2.65, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 17353518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).