2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide

C19H25N3O4S — CID 58924036

IUPAC2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
SMILESCCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)NC(C)(C)CC)c1
InChIInChI=1S/C19H25N3O4S/c1-5-19(3,4)21-18(23)16-9-7-8-10-17(16)27(24,25)22-14-11-15(26-6-2)13-20-12-14/h7-13,22H,5-6H2,1-4H3,(H,21,23)
InChIKeyRIDRMQXQBWLCPT-UHFFFAOYSA-N
MW391.49 g/mol
LogP3.20
Rot. Bonds8

About 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide

2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide (PubChem CID 58924036) has the molecular formula C19H25N3O4S and a molecular weight of 391.49 g/mol. Its IUPAC name is 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
PubChem CID58924036
Molecular FormulaC19H25N3O4S
Molecular Weight391.49 g/mol
Exact Mass391.16
IUPAC Name2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
SMILESCCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)NC(C)(C)CC)c1
InChIInChI=1S/C19H25N3O4S/c1-5-19(3,4)21-18(23)16-9-7-8-10-17(16)27(24,25)22-14-11-15(26-6-2)13-20-12-14/h7-13,22H,5-6H2,1-4H3,(H,21,23)
InChIKeyRIDRMQXQBWLCPT-UHFFFAOYSA-N
XLogP3.20
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.49
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutyl)benzamide
CID 58924307
N-ethyl-2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-propylbenzamide
CID 58924348
2-(4,4-dimethyl-1H-azet-2-yl)-N-(5-ethoxy-3-pyridinyl)benzenesulfonamide
CID 71206558
N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924321
2-(2-methylbutan-2-ylcarbamoyl)benzenesulfonic acid
CID 89214809
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-[(4-methylsulfonylphenyl)methyl]benzamide
CID 58924134
N-[(3,4-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924121
N-[(3-chlorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924260
3-[(4-ethoxyphenyl)sulfamoyl]-4-methyl-N-(2-methylbutan-2-yl)benzamide
CID 43021239
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
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
CID 58924319

Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide?
The IUPAC name of 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide (CID 58924036) is 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide.
What is the SMILES notation for 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide?
The canonical SMILES for 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide is CCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)NC(C)(C)CC)c1.
What is the InChIKey of 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide?
The InChIKey is RIDRMQXQBWLCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4S/c1-5-19(3,4)21-18(23)16-9-7-8-10-17(16)27(24,25)22-14-11-15(26-6-2)13-20-12-14/h7-13,22H,5-6H2,1-4H3,(H,21,23).
What are the key properties of 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide?
2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide has a molecular weight of 391.49 g/mol, XLogP of 3.20, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide is sourced from PubChem (CID 58924036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).