2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide

C19H24N2O5S — CID 3936695

IUPAC2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide
SMILESCOCCCNS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O5S/c1-25-13-5-12-20-27(23,24)17-10-8-16(9-11-17)21-19(22)14-15-6-3-4-7-18(15)26-2/h3-4,6-11,20H,5,12-14H2,1-2H3,(H,21,22)
InChIKeyRTBCBIKUEDOKHX-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.19
Rot. Bonds10

About 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide

2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide (PubChem CID 3936695) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide
PubChem CID3936695
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC Name2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide
SMILESCOCCCNS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O5S/c1-25-13-5-12-20-27(23,24)17-10-8-16(9-11-17)21-19(22)14-15-6-3-4-7-18(15)26-2/h3-4,6-11,20H,5,12-14H2,1-2H3,(H,21,22)
InChIKeyRTBCBIKUEDOKHX-UHFFFAOYSA-N
XLogP2.19
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide (CID 3936695) is 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide is COCCCNS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2OC)cc1.
What is the InChIKey of 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide?
The InChIKey is RTBCBIKUEDOKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-25-13-5-12-20-27(23,24)17-10-8-16(9-11-17)21-19(22)14-15-6-3-4-7-18(15)26-2/h3-4,6-11,20H,5,12-14H2,1-2H3,(H,21,22).
What are the key properties of 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide?
2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide has a molecular weight of 392.48 g/mol, XLogP of 2.19, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 3936695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).