4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide

C13H14N2O3S2 — CID 6486061

IUPAC4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cs1
InChIInChI=1S/C13H14N2O3S2/c14-13(16)12-8-11(9-19-12)20(17,18)15-7-6-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2,(H2,14,16)
InChIKeyAFELVSBTQUVRMM-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.37
Rot. Bonds6

About 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide

4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide (PubChem CID 6486061) has the molecular formula C13H14N2O3S2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide
PubChem CID6486061
Molecular FormulaC13H14N2O3S2
Molecular Weight310.40 g/mol
Exact Mass310.04
IUPAC Name4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cs1
InChIInChI=1S/C13H14N2O3S2/c14-13(16)12-8-11(9-19-12)20(17,18)15-7-6-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2,(H2,14,16)
InChIKeyAFELVSBTQUVRMM-UHFFFAOYSA-N
XLogP1.37
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide?
The IUPAC name of 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide (CID 6486061) is 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide?
The canonical SMILES for 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide is NC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cs1.
What is the InChIKey of 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide?
The InChIKey is AFELVSBTQUVRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S2/c14-13(16)12-8-11(9-19-12)20(17,18)15-7-6-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2,(H2,14,16).
What are the key properties of 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide?
4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethylsulfamoyl)thiophene-2-carboxamide is sourced from PubChem (CID 6486061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).