2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide

C14H15ClN2O4S — CID 891338

IUPAC2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C14H15ClN2O4S/c1-17(2)22(19,20)11-5-6-13(15)12(8-11)14(18)16-9-10-4-3-7-21-10/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyZETQWJVMSMOMTA-UHFFFAOYSA-N
MW342.80 g/mol
LogP2.11
Rot. Bonds5

About 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide

2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide (PubChem CID 891338) has the molecular formula C14H15ClN2O4S and a molecular weight of 342.80 g/mol. Its IUPAC name is 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
PubChem CID891338
Molecular FormulaC14H15ClN2O4S
Molecular Weight342.80 g/mol
Exact Mass342.04
IUPAC Name2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1
InChIInChI=1S/C14H15ClN2O4S/c1-17(2)22(19,20)11-5-6-13(15)12(8-11)14(18)16-9-10-4-3-7-21-10/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyZETQWJVMSMOMTA-UHFFFAOYSA-N
XLogP2.11
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.80
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide (CID 891338) is 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide is CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide?
The InChIKey is ZETQWJVMSMOMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O4S/c1-17(2)22(19,20)11-5-6-13(15)12(8-11)14(18)16-9-10-4-3-7-21-10/h3-8H,9H2,1-2H3,(H,16,18).
What are the key properties of 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide?
2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide has a molecular weight of 342.80 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 891338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).