5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide

C17H19N3O3S — CID 46679817

IUPAC5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)nc1
InChIInChI=1S/C17H19N3O3S/c1-11-3-8-16(18-10-11)19-17(21)15-9-14(7-4-12(15)2)24(22,23)20-13-5-6-13/h3-4,7-10,13,20H,5-6H2,1-2H3,(H,18,19,21)
InChIKeyIPYCDLCCAIEKGM-UHFFFAOYSA-N
MW345.42 g/mol
LogP2.39
Rot. Bonds5

About 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide

5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide (PubChem CID 46679817) has the molecular formula C17H19N3O3S and a molecular weight of 345.42 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide
PubChem CID46679817
Molecular FormulaC17H19N3O3S
Molecular Weight345.42 g/mol
Exact Mass345.11
IUPAC Name5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)nc1
InChIInChI=1S/C17H19N3O3S/c1-11-3-8-16(18-10-11)19-17(21)15-9-14(7-4-12(15)2)24(22,23)20-13-5-6-13/h3-4,7-10,13,20H,5-6H2,1-2H3,(H,18,19,21)
InChIKeyIPYCDLCCAIEKGM-UHFFFAOYSA-N
XLogP2.39
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide (CID 46679817) is 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide is Cc1ccc(NC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)nc1.
What is the InChIKey of 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is IPYCDLCCAIEKGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3S/c1-11-3-8-16(18-10-11)19-17(21)15-9-14(7-4-12(15)2)24(22,23)20-13-5-6-13/h3-4,7-10,13,20H,5-6H2,1-2H3,(H,18,19,21).
What are the key properties of 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide?
5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 345.42 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 46679817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).