N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide

C21H20ClN3O4S — CID 58924321

IUPACN-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)NCCc2ccccc2Cl)c1
InChIInChI=1S/C21H20ClN3O4S/c1-29-17-12-16(13-23-14-17)25-30(27,28)20-9-5-3-7-18(20)21(26)24-11-10-15-6-2-4-8-19(15)22/h2-9,12-14,25H,10-11H2,1H3,(H,24,26)
InChIKeyWYDFZTPBMVKRGJ-UHFFFAOYSA-N
MW445.93 g/mol
LogP3.52
Rot. Bonds8

About N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide

N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide (PubChem CID 58924321) has the molecular formula C21H20ClN3O4S and a molecular weight of 445.93 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
PubChem CID58924321
Molecular FormulaC21H20ClN3O4S
Molecular Weight445.93 g/mol
Exact Mass445.09
IUPAC NameN-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
SMILESCOc1cncc(NS(=O)(=O)c2ccccc2C(=O)NCCc2ccccc2Cl)c1
InChIInChI=1S/C21H20ClN3O4S/c1-29-17-12-16(13-23-14-17)25-30(27,28)20-9-5-3-7-18(20)21(26)24-11-10-15-6-2-4-8-19(15)22/h2-9,12-14,25H,10-11H2,1H3,(H,24,26)
InChIKeyWYDFZTPBMVKRGJ-UHFFFAOYSA-N
XLogP3.52
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.93
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2,5-difluorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924145
N-[(2,3-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924343
N-[(3-chlorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924260
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-[(3,4-difluorophenyl)methyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide
CID 58924121
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
2-[(5-methoxy-3-pyridinyl)sulfamoyl]-N-methyl-N-(2-phenoxyethyl)benzamide
CID 58924319
2-[(5-ethoxy-3-pyridinyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
CID 58924036
N-(5-methoxy-3-pyridinyl)-2-(trifluoromethyl)benzenesulfonamide
CID 134137036
4-chloro-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 103867838

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide?
The IUPAC name of N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide (CID 58924321) is N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide?
The canonical SMILES for N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide is COc1cncc(NS(=O)(=O)c2ccccc2C(=O)NCCc2ccccc2Cl)c1.
What is the InChIKey of N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide?
The InChIKey is WYDFZTPBMVKRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O4S/c1-29-17-12-16(13-23-14-17)25-30(27,28)20-9-5-3-7-18(20)21(26)24-11-10-15-6-2-4-8-19(15)22/h2-9,12-14,25H,10-11H2,1H3,(H,24,26).
What are the key properties of N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide?
N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide has a molecular weight of 445.93 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)ethyl]-2-[(5-methoxy-3-pyridinyl)sulfamoyl]benzamide is sourced from PubChem (CID 58924321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).