2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide

C22H23N3O5S — CID 58924319

IUPAC2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(C)CCOc2ccccc2)c1
InChIInChI=1S/C22H23N3O5S/c1-25(12-13-30-18-8-4-3-5-9-18)22(26)20-10-6-7-11-21(20)31(27,28)24-17-14-19(29-2)16-23-15-17/h3-11,14-16,24H,12-13H2,1-2H3
InChIKeyXEYMGNZVXUNPJE-UHFFFAOYSA-N
MW441.51 g/mol
LogP3.04
Rot. Bonds9

About 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide

2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide (PubChem CID 58924319) has the molecular formula C22H23N3O5S and a molecular weight of 441.51 g/mol. Its IUPAC name is 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide.

Molecular Properties

Compound Name2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
PubChem CID58924319
Molecular FormulaC22H23N3O5S
Molecular Weight441.51 g/mol
Exact Mass441.14
IUPAC Name2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(C)CCOc2ccccc2)c1
InChIInChI=1S/C22H23N3O5S/c1-25(12-13-30-18-8-4-3-5-9-18)22(26)20-10-6-7-11-21(20)31(27,28)24-17-14-19(29-2)16-23-15-17/h3-11,14-16,24H,12-13H2,1-2H3
InChIKeyXEYMGNZVXUNPJE-UHFFFAOYSA-N
XLogP3.04
TPSA97.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.51
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propylbenzamide
CID 58924348
N-(2-hydroxyethyl)-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 58924202
N-butyl-N-methyl-2-[(5-methyl-3-pyridinyl)sulfamoyl]benzamide
CID 58924138
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutyl)benzamide
CID 58924307
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-[(4-methylsulfonylphenyl)methyl]benzamide
CID 58924134
N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924321
N-[(3-chlorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924260
N-[(3,4-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924121
N-[(2,3-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924343
N-[2-(2,5-difluorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924145
N-(5-methoxy-3-pyridinyl)-2-(trifluoromethyl)benzenesulfonamide
CID 134137036
2-(3,3-dimethylpiperidine-1-carbonyl)-N-(5-methoxy-3-pyridinyl)benzenesulfonamide
CID 58924081

Frequently Asked Questions

What is the IUPAC name of 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The IUPAC name of 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide (CID 58924319) is 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide.
What is the SMILES notation for 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The canonical SMILES for 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide is COc1cncc(NS(=O)(=O)c2ccccc2C(=O)N(C)CCOc2ccccc2)c1.
What is the InChIKey of 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The InChIKey is XEYMGNZVXUNPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O5S/c1-25(12-13-30-18-8-4-3-5-9-18)22(26)20-10-6-7-11-21(20)31(27,28)24-17-14-19(29-2)16-23-15-17/h3-11,14-16,24H,12-13H2,1-2H3.
What are the key properties of 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide has a molecular weight of 441.51 g/mol, XLogP of 3.04, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide is sourced from PubChem (CID 58924319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).