3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide

C20H26N2O4S — CID 26414114

IUPAC3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C)ccc2OC)ccc1C
InChIInChI=1S/C20H26N2O4S/c1-6-22(7-2)27(24,25)19-13-16(10-9-15(19)4)20(23)21-17-12-14(3)8-11-18(17)26-5/h8-13H,6-7H2,1-5H3,(H,21,23)
InChIKeyPPEXMHNFEMJYRH-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.59
Rot. Bonds7

About 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide

3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide (PubChem CID 26414114) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide
PubChem CID26414114
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC Name3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide
SMILESCCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C)ccc2OC)ccc1C
InChIInChI=1S/C20H26N2O4S/c1-6-22(7-2)27(24,25)19-13-16(10-9-15(19)4)20(23)21-17-12-14(3)8-11-18(17)26-5/h8-13H,6-7H2,1-5H3,(H,21,23)
InChIKeyPPEXMHNFEMJYRH-UHFFFAOYSA-N
XLogP3.59
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-acetamido-2-methoxyphenyl)-3-(diethylsulfamoyl)-4-methylbenzamide
CID 26243070
2-[(2,5-dimethylphenyl)sulfonyl-ethylamino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 100781520
3-(diethylsulfamoyl)-N-[2-(2-methoxy-5-methylphenyl)ethyl]-4-methylbenzamide
CID 26457205
N-(3-amino-4-methoxyphenyl)-3-(diethylsulfamoyl)-4-methylbenzamide
CID 119420241
3-(diethylsulfamoyl)-4-methyl-N-(4-methylphenyl)benzamide
CID 2876161
4-methoxy-N-(2-methoxy-5-methylphenyl)-3-(propylsulfamoyl)benzamide
CID 18892416
N,N-diethyl-2-methyl-5-[[(4-methylbenzoyl)amino]carbamoyl]benzenesulfonamide
CID 2648443
5-(diethylsulfamoyl)-N-(2,5-dimethylphenyl)-2-methoxybenzamide
CID 19257768
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(2,5-dimethylanilino)acetamide
CID 26505603
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 4857711
3-(diethylsulfamoyl)-4-methyl-N-(3-methylphenyl)benzamide
CID 2540395
3-(diethylsulfamoyl)-4-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 18106773

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide?
The IUPAC name of 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide (CID 26414114) is 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide is CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C)ccc2OC)ccc1C.
What is the InChIKey of 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide?
The InChIKey is PPEXMHNFEMJYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-6-22(7-2)27(24,25)19-13-16(10-9-15(19)4)20(23)21-17-12-14(3)8-11-18(17)26-5/h8-13H,6-7H2,1-5H3,(H,21,23).
What are the key properties of 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide?
3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide has a molecular weight of 390.51 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide is sourced from PubChem (CID 26414114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).