N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide

C17H19N3O5S — CID 26584175

IUPACN-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C17H19N3O5S/c1-12(21)19-13-4-3-5-14(10-13)20-17(22)11-18-26(23,24)16-8-6-15(25-2)7-9-16/h3-10,18H,11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyUJEJVWIKOYJGGK-UHFFFAOYSA-N
MW377.42 g/mol
LogP1.57
Rot. Bonds7

About N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide

N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide (PubChem CID 26584175) has the molecular formula C17H19N3O5S and a molecular weight of 377.42 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
PubChem CID26584175
Molecular FormulaC17H19N3O5S
Molecular Weight377.42 g/mol
Exact Mass377.10
IUPAC NameN-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C17H19N3O5S/c1-12(21)19-13-4-3-5-14(10-13)20-17(22)11-18-26(23,24)16-8-6-15(25-2)7-9-16/h3-10,18H,11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyUJEJVWIKOYJGGK-UHFFFAOYSA-N
XLogP1.57
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide (CID 26584175) is N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide is COc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)cc1.
What is the InChIKey of N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide?
The InChIKey is UJEJVWIKOYJGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O5S/c1-12(21)19-13-4-3-5-14(10-13)20-17(22)11-18-26(23,24)16-8-6-15(25-2)7-9-16/h3-10,18H,11H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide?
N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide has a molecular weight of 377.42 g/mol, XLogP of 1.57, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 26584175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).