5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide

C14H16N2O4S — CID 2809675

IUPAC5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide
SMILESCc1oc(S(=O)(=O)N(C)C)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H16N2O4S/c1-10-12(9-13(20-10)21(18,19)16(2)3)14(17)15-11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,17)
InChIKeyCGVYVMWOEHXVEW-UHFFFAOYSA-N
MW308.36 g/mol
LogP2.09
Rot. Bonds4

About 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide

5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide (PubChem CID 2809675) has the molecular formula C14H16N2O4S and a molecular weight of 308.36 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide
PubChem CID2809675
Molecular FormulaC14H16N2O4S
Molecular Weight308.36 g/mol
Exact Mass308.08
IUPAC Name5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide
SMILESCc1oc(S(=O)(=O)N(C)C)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C14H16N2O4S/c1-10-12(9-13(20-10)21(18,19)16(2)3)14(17)15-11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,17)
InChIKeyCGVYVMWOEHXVEW-UHFFFAOYSA-N
XLogP2.09
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide?
The IUPAC name of 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide (CID 2809675) is 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide is Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)Nc1ccccc1.
What is the InChIKey of 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide?
The InChIKey is CGVYVMWOEHXVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4S/c1-10-12(9-13(20-10)21(18,19)16(2)3)14(17)15-11-7-5-4-6-8-11/h4-9H,1-3H3,(H,15,17).
What are the key properties of 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide?
5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide has a molecular weight of 308.36 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-2-methyl-N-phenylfuran-3-carboxamide is sourced from PubChem (CID 2809675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).