5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid

C11H11NO5S2 — CID 61473467

IUPAC5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)NCCc2ccsc2)o1
InChIInChI=1S/C11H11NO5S2/c13-11(14)9-1-2-10(17-9)19(15,16)12-5-3-8-4-6-18-7-8/h1-2,4,6-7,12H,3,5H2,(H,13,14)
InChIKeyUUMZPMPDHUBOPX-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.56
Rot. Bonds6

About 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid

5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid (PubChem CID 61473467) has the molecular formula C11H11NO5S2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid.

Molecular Properties

Compound Name5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid
PubChem CID61473467
Molecular FormulaC11H11NO5S2
Molecular Weight301.35 g/mol
Exact Mass301.01
IUPAC Name5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)NCCc2ccsc2)o1
InChIInChI=1S/C11H11NO5S2/c13-11(14)9-1-2-10(17-9)19(15,16)12-5-3-8-4-6-18-7-8/h1-2,4,6-7,12H,3,5H2,(H,13,14)
InChIKeyUUMZPMPDHUBOPX-UHFFFAOYSA-N
XLogP1.56
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-(3-methylphenyl)ethylsulfamoyl]furan-2-carboxylic acid
CID 62313553
5-(ethylsulfamoyl)furan-2-carboxylic acid
CID 43149834
5-[2-(methylsulfamoyl)ethylsulfamoyl]furan-2-carboxylic acid
CID 106335110
5-[2-(4-methylpiperazin-1-yl)ethylsulfamoyl]furan-2-carboxylic acid
CID 60924480
5-(2-thiophen-3-ylethylsulfamoyl)-1H-pyrazole-4-carboxylic acid
CID 61473154
5-[3-(dimethylamino)propylsulfamoyl]furan-2-carboxylic acid
CID 29077453
3-bromo-4-(2-thiophen-3-ylethylsulfamoyl)benzoic acid
CID 61473152
5-(2,2,2-trifluoroethylsulfamoyl)furan-2-carboxylic acid
CID 29077583
5-(3-methylsulfanylbutylsulfamoyl)furan-2-carboxylic acid
CID 113493885
5-[[3-(diethylamino)-3-oxopropyl]sulfamoyl]furan-2-carboxylic acid
CID 60926737
5-[[(2S)-2-hydroxypropyl]sulfamoyl]furan-2-carboxylic acid
CID 107216107
5-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfamoyl]furan-2-carboxylic acid
CID 104932979

Frequently Asked Questions

What is the IUPAC name of 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid?
The IUPAC name of 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid (CID 61473467) is 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid.
What is the SMILES notation for 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid?
The canonical SMILES for 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid is O=C(O)c1ccc(S(=O)(=O)NCCc2ccsc2)o1.
What is the InChIKey of 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid?
The InChIKey is UUMZPMPDHUBOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO5S2/c13-11(14)9-1-2-10(17-9)19(15,16)12-5-3-8-4-6-18-7-8/h1-2,4,6-7,12H,3,5H2,(H,13,14).
What are the key properties of 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid?
5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid has a molecular weight of 301.35 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-thiophen-3-ylethylsulfamoyl)furan-2-carboxylic acid is sourced from PubChem (CID 61473467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).