N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide

C20H19N3O3S — CID 1118249

IUPACN-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccccn2)cc1
InChIInChI=1S/C20H19N3O3S/c1-16(24)22-18-10-12-19(13-11-18)27(25,26)23(20-9-5-6-14-21-20)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,22,24)
InChIKeyMDZSHFJKEJLBLV-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.44
Rot. Bonds6

About N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide

N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide (PubChem CID 1118249) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide
PubChem CID1118249
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC NameN-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccccn2)cc1
InChIInChI=1S/C20H19N3O3S/c1-16(24)22-18-10-12-19(13-11-18)27(25,26)23(20-9-5-6-14-21-20)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,22,24)
InChIKeyMDZSHFJKEJLBLV-UHFFFAOYSA-N
XLogP3.44
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide (CID 1118249) is N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccccn2)cc1.
What is the InChIKey of N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is MDZSHFJKEJLBLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-16(24)22-18-10-12-19(13-11-18)27(25,26)23(20-9-5-6-14-21-20)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,22,24).
What are the key properties of N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide?
N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 381.46 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[benzyl(pyridin-2-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 1118249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).