5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide

C16H19N3O3S — CID 35033520

IUPAC5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ncccc2C)c1
InChIInChI=1S/C16H19N3O3S/c1-4-18-23(21,22)13-8-7-11(2)14(10-13)16(20)19-15-12(3)6-5-9-17-15/h5-10,18H,4H2,1-3H3,(H,17,19,20)
InChIKeyBTCSFHBINIUHES-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.25
Rot. Bonds5

About 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide

5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide (PubChem CID 35033520) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
PubChem CID35033520
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC Name5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ncccc2C)c1
InChIInChI=1S/C16H19N3O3S/c1-4-18-23(21,22)13-8-7-11(2)14(10-13)16(20)19-15-12(3)6-5-9-17-15/h5-10,18H,4H2,1-3H3,(H,17,19,20)
InChIKeyBTCSFHBINIUHES-UHFFFAOYSA-N
XLogP2.25
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylsulfamoyl)-N,2-dimethylbenzamide
CID 6461284
5-(ethylsulfamoyl)-2-methyl-N-(1H-pyrazol-4-yl)benzamide
CID 46412123
5-(ethylsulfamoyl)-N-[(2-methoxy-3-pyridinyl)methyl]-2-methylbenzamide
CID 37485846
N-(2-chlorophenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 35345609
5-bromo-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
CID 65307070
N-(5-chloro-2-methylphenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 43007142
5-(ethylsulfamoyl)-2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 25486579
N-(2-aminoethyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 119382412
5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 27648413
N-[2-(ethylaminomethyl)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 119438951
N-(3,5-dimethyl-1,2-oxazol-4-yl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 51101805
N-butyl-5-(ethylsulfamoyl)-2-methylbenzamide
CID 35710044

Frequently Asked Questions

What is the IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide?
The IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide (CID 35033520) is 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide is CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ncccc2C)c1.
What is the InChIKey of 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide?
The InChIKey is BTCSFHBINIUHES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c1-4-18-23(21,22)13-8-7-11(2)14(10-13)16(20)19-15-12(3)6-5-9-17-15/h5-10,18H,4H2,1-3H3,(H,17,19,20).
What are the key properties of 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide?
5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide has a molecular weight of 333.41 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylsulfamoyl)-2-methyl-N-(3-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 35033520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).