4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide

C20H20N2O5S — CID 7656179

IUPAC4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1
InChIInChI=1S/C20H20N2O5S/c1-22(14-16-6-5-13-27-16)28(24,25)17-11-9-15(10-12-17)20(23)21-18-7-3-4-8-19(18)26-2/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyIENCUZRCVUIADI-UHFFFAOYSA-N
MW400.46 g/mol
LogP3.36
Rot. Bonds7

About 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide

4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide (PubChem CID 7656179) has the molecular formula C20H20N2O5S and a molecular weight of 400.46 g/mol. Its IUPAC name is 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
PubChem CID7656179
Molecular FormulaC20H20N2O5S
Molecular Weight400.46 g/mol
Exact Mass400.11
IUPAC Name4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1
InChIInChI=1S/C20H20N2O5S/c1-22(14-16-6-5-13-27-16)28(24,25)17-11-9-15(10-12-17)20(23)21-18-7-3-4-8-19(18)26-2/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyIENCUZRCVUIADI-UHFFFAOYSA-N
XLogP3.36
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide (CID 7656179) is 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccco2)cc1.
What is the InChIKey of 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide?
The InChIKey is IENCUZRCVUIADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O5S/c1-22(14-16-6-5-13-27-16)28(24,25)17-11-9-15(10-12-17)20(23)21-18-7-3-4-8-19(18)26-2/h3-13H,14H2,1-2H3,(H,21,23).
What are the key properties of 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide?
4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide has a molecular weight of 400.46 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[furan-2-ylmethyl(methyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 7656179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).