N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide

C14H16N2O3S2 — CID 4805705

IUPACN-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccsc2)c1
InChIInChI=1S/C14H16N2O3S2/c1-16(2)21(18,19)13-5-3-4-12(9-13)15-14(17)8-11-6-7-20-10-11/h3-7,9-10H,8H2,1-2H3,(H,15,17)
InChIKeyQDEJHLDKVWDMRA-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.18
Rot. Bonds5

About N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide (PubChem CID 4805705) has the molecular formula C14H16N2O3S2 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide
PubChem CID4805705
Molecular FormulaC14H16N2O3S2
Molecular Weight324.43 g/mol
Exact Mass324.06
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccsc2)c1
InChIInChI=1S/C14H16N2O3S2/c1-16(2)21(18,19)13-5-3-4-12(9-13)15-14(17)8-11-6-7-20-10-11/h3-7,9-10H,8H2,1-2H3,(H,15,17)
InChIKeyQDEJHLDKVWDMRA-UHFFFAOYSA-N
XLogP2.18
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide (CID 4805705) is N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide is CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccsc2)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide?
The InChIKey is QDEJHLDKVWDMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S2/c1-16(2)21(18,19)13-5-3-4-12(9-13)15-14(17)8-11-6-7-20-10-11/h3-7,9-10H,8H2,1-2H3,(H,15,17).
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide?
N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide has a molecular weight of 324.43 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 4805705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).