5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide

C17H21N3O4S — CID 46651612

IUPAC5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cc(C)ccn2)c1
InChIInChI=1S/C17H21N3O4S/c1-12-6-7-18-16(10-12)20-17(21)15-11-14(5-4-13(15)2)25(22,23)19-8-9-24-3/h4-7,10-11,19H,8-9H2,1-3H3,(H,18,20,21)
InChIKeyJDRLPNZDTKZXAZ-UHFFFAOYSA-N
MW363.44 g/mol
LogP1.88
Rot. Bonds7

About 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide

5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide (PubChem CID 46651612) has the molecular formula C17H21N3O4S and a molecular weight of 363.44 g/mol. Its IUPAC name is 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide
PubChem CID46651612
Molecular FormulaC17H21N3O4S
Molecular Weight363.44 g/mol
Exact Mass363.13
IUPAC Name5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cc(C)ccn2)c1
InChIInChI=1S/C17H21N3O4S/c1-12-6-7-18-16(10-12)20-17(21)15-11-14(5-4-13(15)2)25(22,23)19-8-9-24-3/h4-7,10-11,19H,8-9H2,1-3H3,(H,18,20,21)
InChIKeyJDRLPNZDTKZXAZ-UHFFFAOYSA-N
XLogP1.88
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(benzylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide
CID 25163680
N-(2-hydroxy-4-methylphenyl)-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 46652713
N-(3-chloro-4-methylphenyl)-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 46674398
5-(2-methoxyethylsulfamoyl)-2-methyl-N-[2-(methylamino)ethyl]benzamide
CID 119500095
5-(2-methoxyethylsulfamoyl)-N,N,2-trimethylbenzamide
CID 43002807
5-(2-methoxyethylsulfamoyl)-2-methyl-N-(3-phenyl-1,2,4-thiadiazol-5-yl)benzamide
CID 56503128
N-heptan-2-yl-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 46515959
2-chloro-5-[(3-chloro-4-methylphenyl)sulfamoyl]-N-(4-methyl-2-pyridinyl)benzamide
CID 35030055
methyl 5-[2-(2-methoxyethylamino)ethylsulfamoyl]-2-methylbenzoate
CID 120717694
5-(2-methoxyethylsulfamoyl)-2-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 51164465
N-(3-ethoxypropyl)-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 43002878
methyl 5-[2-(2,4-dimethylphenoxy)ethylsulfamoyl]-2-methylbenzoate
CID 100558556

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide?
The IUPAC name of 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide (CID 46651612) is 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide is COCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cc(C)ccn2)c1.
What is the InChIKey of 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide?
The InChIKey is JDRLPNZDTKZXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O4S/c1-12-6-7-18-16(10-12)20-17(21)15-11-14(5-4-13(15)2)25(22,23)19-8-9-24-3/h4-7,10-11,19H,8-9H2,1-3H3,(H,18,20,21).
What are the key properties of 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide?
5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide has a molecular weight of 363.44 g/mol, XLogP of 1.88, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethylsulfamoyl)-2-methyl-N-(4-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 46651612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).