2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide

C22H28ClN3O4S — CID 3984944

IUPAC2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C22H28ClN3O4S/c1-3-26(4-2)31(28,29)19-9-10-21(25-11-13-30-14-12-25)20(16-19)24-22(27)15-17-5-7-18(23)8-6-17/h5-10,16H,3-4,11-15H2,1-2H3,(H,24,27)
InChIKeyUSVZWYLKPWXQPZ-UHFFFAOYSA-N
MW466.00 g/mol
LogP3.39
Rot. Bonds8

About 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide

2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide (PubChem CID 3984944) has the molecular formula C22H28ClN3O4S and a molecular weight of 466.00 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide
PubChem CID3984944
Molecular FormulaC22H28ClN3O4S
Molecular Weight466.00 g/mol
Exact Mass465.15
IUPAC Name2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C22H28ClN3O4S/c1-3-26(4-2)31(28,29)19-9-10-21(25-11-13-30-14-12-25)20(16-19)24-22(27)15-17-5-7-18(23)8-6-17/h5-10,16H,3-4,11-15H2,1-2H3,(H,24,27)
InChIKeyUSVZWYLKPWXQPZ-UHFFFAOYSA-N
XLogP3.39
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.00
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide (CID 3984944) is 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide is CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(NC(=O)Cc2ccc(Cl)cc2)c1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide?
The InChIKey is USVZWYLKPWXQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28ClN3O4S/c1-3-26(4-2)31(28,29)19-9-10-21(25-11-13-30-14-12-25)20(16-19)24-22(27)15-17-5-7-18(23)8-6-17/h5-10,16H,3-4,11-15H2,1-2H3,(H,24,27).
What are the key properties of 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide?
2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide has a molecular weight of 466.00 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]acetamide is sourced from PubChem (CID 3984944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).