5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide

C22H23N3O4S — CID 55971765

IUPAC5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C)cc3)nc2)c1
InChIInChI=1S/C22H23N3O4S/c1-4-24-30(27,28)19-11-7-16(3)20(13-19)22(26)25-17-8-12-21(23-14-17)29-18-9-5-15(2)6-10-18/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyPMSCGXHAYHFYEE-UHFFFAOYSA-N
MW425.51 g/mol
LogP4.04
Rot. Bonds7

About 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide

5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide (PubChem CID 55971765) has the molecular formula C22H23N3O4S and a molecular weight of 425.51 g/mol. Its IUPAC name is 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide
PubChem CID55971765
Molecular FormulaC22H23N3O4S
Molecular Weight425.51 g/mol
Exact Mass425.14
IUPAC Name5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C)cc3)nc2)c1
InChIInChI=1S/C22H23N3O4S/c1-4-24-30(27,28)19-11-7-16(3)20(13-19)22(26)25-17-8-12-21(23-14-17)29-18-9-5-15(2)6-10-18/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyPMSCGXHAYHFYEE-UHFFFAOYSA-N
XLogP4.04
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.51
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(ethylsulfamoyl)-2-methyl-N-(1H-pyrazol-4-yl)benzamide
CID 46412123
N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 39971961
N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297742
5-(ethylsulfamoyl)-2-methyl-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167610
5-(ethylsulfamoyl)-2-methyl-N-[(6-propan-2-yloxy-3-pyridinyl)methyl]benzamide
CID 55747623
5-(ethylsulfamoyl)-N,2-dimethylbenzamide
CID 6461284
5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
CID 35033520
3-(cyclopropylsulfamoyl)-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide
CID 55787755
5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 27648413
N-(4-ethoxyphenyl)-5-[(4-fluorophenyl)sulfamoyl]-2-methylbenzamide
CID 26561579
N-(5-acetamido-2-methoxyphenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 42112029
N-(5-chloro-2-methylphenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 43007142

Frequently Asked Questions

What is the IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide?
The IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide (CID 55971765) is 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide.
What is the SMILES notation for 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide?
The canonical SMILES for 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide is CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C)cc3)nc2)c1.
What is the InChIKey of 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide?
The InChIKey is PMSCGXHAYHFYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4S/c1-4-24-30(27,28)19-11-7-16(3)20(13-19)22(26)25-17-8-12-21(23-14-17)29-18-9-5-15(2)6-10-18/h5-14,24H,4H2,1-3H3,(H,25,26).
What are the key properties of 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide?
5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide has a molecular weight of 425.51 g/mol, XLogP of 4.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide is sourced from PubChem (CID 55971765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).