5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide

C19H17ClN2O4S — CID 46476619

IUPAC5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide
SMILESCS(=O)(=O)Nc1ccccc1CNC(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C19H17ClN2O4S/c1-27(24,25)22-16-9-5-2-6-13(16)12-21-19(23)18-11-10-17(26-18)14-7-3-4-8-15(14)20/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyNXXUQBXJURZPFL-UHFFFAOYSA-N
MW404.88 g/mol
LogP3.90
Rot. Bonds6

About 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide

5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide (PubChem CID 46476619) has the molecular formula C19H17ClN2O4S and a molecular weight of 404.88 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide
PubChem CID46476619
Molecular FormulaC19H17ClN2O4S
Molecular Weight404.88 g/mol
Exact Mass404.06
IUPAC Name5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide
SMILESCS(=O)(=O)Nc1ccccc1CNC(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C19H17ClN2O4S/c1-27(24,25)22-16-9-5-2-6-13(16)12-21-19(23)18-11-10-17(26-18)14-7-3-4-8-15(14)20/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyNXXUQBXJURZPFL-UHFFFAOYSA-N
XLogP3.90
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.88
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide 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 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide?
The IUPAC name of 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide (CID 46476619) is 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide?
The canonical SMILES for 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide is CS(=O)(=O)Nc1ccccc1CNC(=O)c1ccc(-c2ccccc2Cl)o1.
What is the InChIKey of 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide?
The InChIKey is NXXUQBXJURZPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O4S/c1-27(24,25)22-16-9-5-2-6-13(16)12-21-19(23)18-11-10-17(26-18)14-7-3-4-8-15(14)20/h2-11,22H,12H2,1H3,(H,21,23).
What are the key properties of 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide?
5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide has a molecular weight of 404.88 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]furan-2-carboxamide is sourced from PubChem (CID 46476619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).