N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide

C20H26N2O5S — CID 7936803

IUPACN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C20H26N2O5S/c1-5-22(6-2)28(24,25)17-11-12-19(27-7-3)18(14-17)21-20(23)15-9-8-10-16(13-15)26-4/h8-14H,5-7H2,1-4H3,(H,21,23)
InChIKeyHOCAGLTWHNROAR-UHFFFAOYSA-N
MW406.50 g/mol
LogP3.38
Rot. Bonds9

About N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide

N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide (PubChem CID 7936803) has the molecular formula C20H26N2O5S and a molecular weight of 406.50 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide
PubChem CID7936803
Molecular FormulaC20H26N2O5S
Molecular Weight406.50 g/mol
Exact Mass406.16
IUPAC NameN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C20H26N2O5S/c1-5-22(6-2)28(24,25)17-11-12-19(27-7-3)18(14-17)21-20(23)15-9-8-10-16(13-15)26-4/h8-14H,5-7H2,1-4H3,(H,21,23)
InChIKeyHOCAGLTWHNROAR-UHFFFAOYSA-N
XLogP3.38
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.50
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-4-methoxybenzamide
CID 8501680
3-(diethylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 4003550
N-[5-(diethylsulfamoyl)-2-(dimethylamino)phenyl]-3-methoxybenzamide
CID 8960845
3-(diethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591095
N-[4-(diethylsulfamoyl)phenyl]-3-ethoxybenzamide
CID 4957423
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4,5-trimethoxybenzamide
CID 2913924
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2,6-dimethoxybenzamide
CID 3482622
N-(5-bromo-2-methoxyphenyl)-3-(diethylsulfamoyl)benzamide
CID 52707757
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2-methyl-3-nitrobenzamide
CID 26891825
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-iodobenzamide
CID 26901201
3-(butylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 17226790
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-phenylmethoxybenzamide
CID 5140341

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide (CID 7936803) is N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide is CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cccc(OC)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide?
The InChIKey is HOCAGLTWHNROAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O5S/c1-5-22(6-2)28(24,25)17-11-12-19(27-7-3)18(14-17)21-20(23)15-9-8-10-16(13-15)26-4/h8-14H,5-7H2,1-4H3,(H,21,23).
What are the key properties of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide?
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide has a molecular weight of 406.50 g/mol, XLogP of 3.38, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide is sourced from PubChem (CID 7936803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).