N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide

C20H20N2O5S2 — CID 2090209

IUPACN-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
SMILESCOc1cccc(NC(=O)CN(c2ccccc2OC)S(=O)(=O)c2cccs2)c1
InChIInChI=1S/C20H20N2O5S2/c1-26-16-8-5-7-15(13-16)21-19(23)14-22(17-9-3-4-10-18(17)27-2)29(24,25)20-11-6-12-28-20/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyYECKBYOABQDXET-UHFFFAOYSA-N
MW432.52 g/mol
LogP3.60
Rot. Bonds8

About N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide

N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide (PubChem CID 2090209) has the molecular formula C20H20N2O5S2 and a molecular weight of 432.52 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
PubChem CID2090209
Molecular FormulaC20H20N2O5S2
Molecular Weight432.52 g/mol
Exact Mass432.08
IUPAC NameN-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
SMILESCOc1cccc(NC(=O)CN(c2ccccc2OC)S(=O)(=O)c2cccs2)c1
InChIInChI=1S/C20H20N2O5S2/c1-26-16-8-5-7-15(13-16)21-19(23)14-22(17-9-3-4-10-18(17)27-2)29(24,25)20-11-6-12-28-20/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyYECKBYOABQDXET-UHFFFAOYSA-N
XLogP3.60
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.52
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide (CID 2090209) is N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide is COc1cccc(NC(=O)CN(c2ccccc2OC)S(=O)(=O)c2cccs2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide?
The InChIKey is YECKBYOABQDXET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O5S2/c1-26-16-8-5-7-15(13-16)21-19(23)14-22(17-9-3-4-10-18(17)27-2)29(24,25)20-11-6-12-28-20/h3-13H,14H2,1-2H3,(H,21,23).
What are the key properties of N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide?
N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide has a molecular weight of 432.52 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide is sourced from PubChem (CID 2090209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).