3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide

C20H19N3O3S — CID 2334656

IUPAC3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)n1
InChIInChI=1S/C20H19N3O3S/c1-15-8-6-13-19(21-15)22-20(24)16-9-7-12-18(14-16)27(25,26)23(2)17-10-4-3-5-11-17/h3-14H,1-2H3,(H,21,22,24)
InChIKeyRYOZNGLBYJBHLS-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.47
Rot. Bonds5

About 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide

3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide (PubChem CID 2334656) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide
PubChem CID2334656
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC Name3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)n1
InChIInChI=1S/C20H19N3O3S/c1-15-8-6-13-19(21-15)22-20(24)16-9-7-12-18(14-16)27(25,26)23(2)17-10-4-3-5-11-17/h3-14H,1-2H3,(H,21,22,24)
InChIKeyRYOZNGLBYJBHLS-UHFFFAOYSA-N
XLogP3.47
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide (CID 2334656) is 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide is Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)n1.
What is the InChIKey of 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide?
The InChIKey is RYOZNGLBYJBHLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-15-8-6-13-19(21-15)22-20(24)16-9-7-12-18(14-16)27(25,26)23(2)17-10-4-3-5-11-17/h3-14H,1-2H3,(H,21,22,24).
What are the key properties of 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide?
3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide has a molecular weight of 381.46 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(phenyl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 2334656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).