2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide

C16H16N2O5S — CID 44629469

IUPAC2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide
SMILESO=NC(=O)CN(CCO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H16N2O5S/c19-11-10-18(12-16(20)17-21)24(22,23)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,19H,10-12H2
InChIKeyWXANCNKNSTWLDT-UHFFFAOYSA-N
MW348.38 g/mol
LogP1.63
Rot. Bonds7

About 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide

2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide (PubChem CID 44629469) has the molecular formula C16H16N2O5S and a molecular weight of 348.38 g/mol. Its IUPAC name is 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide
PubChem CID44629469
Molecular FormulaC16H16N2O5S
Molecular Weight348.38 g/mol
Exact Mass348.08
IUPAC Name2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide
SMILESO=NC(=O)CN(CCO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H16N2O5S/c19-11-10-18(12-16(20)17-21)24(22,23)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,19H,10-12H2
InChIKeyWXANCNKNSTWLDT-UHFFFAOYSA-N
XLogP1.63
TPSA104.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.38
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide?
The IUPAC name of 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide (CID 44629469) is 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide.
What is the SMILES notation for 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide?
The canonical SMILES for 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide is O=NC(=O)CN(CCO)S(=O)(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide?
The InChIKey is WXANCNKNSTWLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O5S/c19-11-10-18(12-16(20)17-21)24(22,23)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,19H,10-12H2.
What are the key properties of 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide?
2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide has a molecular weight of 348.38 g/mol, XLogP of 1.63, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl-(4-phenylphenyl)sulfonylamino]-N-oxoacetamide is sourced from PubChem (CID 44629469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).