5-(ethylsulfamoyl)furan-2-carboxylic acid

C7H9NO5S — CID 43149834

IUPAC5-(ethylsulfamoyl)furan-2-carboxylic acid
SMILESCCNS(=O)(=O)c1ccc(C(=O)O)o1
InChIInChI=1S/C7H9NO5S/c1-2-8-14(11,12)6-4-3-5(13-6)7(9)10/h3-4,8H,2H2,1H3,(H,9,10)
InChIKeyORADTNBBZPVRJI-UHFFFAOYSA-N
MW219.22 g/mol
LogP0.28
Rot. Bonds4

About 5-(ethylsulfamoyl)furan-2-carboxylic acid

5-(ethylsulfamoyl)furan-2-carboxylic acid (PubChem CID 43149834) has the molecular formula C7H9NO5S and a molecular weight of 219.22 g/mol. Its IUPAC name is 5-(ethylsulfamoyl)furan-2-carboxylic acid.

Molecular Properties

Compound Name5-(ethylsulfamoyl)furan-2-carboxylic acid
PubChem CID43149834
Molecular FormulaC7H9NO5S
Molecular Weight219.22 g/mol
Exact Mass219.02
IUPAC Name5-(ethylsulfamoyl)furan-2-carboxylic acid
SMILESCCNS(=O)(=O)c1ccc(C(=O)O)o1
InChIInChI=1S/C7H9NO5S/c1-2-8-14(11,12)6-4-3-5(13-6)7(9)10/h3-4,8H,2H2,1H3,(H,9,10)
InChIKeyORADTNBBZPVRJI-UHFFFAOYSA-N
XLogP0.28
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[(2S)-2-hydroxypropyl]sulfamoyl]furan-2-carboxylic acid
CID 107216107
5-(2,2,2-trifluoroethylsulfamoyl)furan-2-carboxylic acid
CID 29077583
5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid
CID 43149833
5-[2-(methylsulfamoyl)ethylsulfamoyl]furan-2-carboxylic acid
CID 106335110
5-[[3-(diethylamino)-3-oxopropyl]sulfamoyl]furan-2-carboxylic acid
CID 60926737
5-(3-methylpentan-3-ylsulfamoyl)furan-2-carboxylic acid
CID 106328341
5-[3-(dimethylamino)propylsulfamoyl]furan-2-carboxylic acid
CID 29077453
5-(3-methylsulfanylbutylsulfamoyl)furan-2-carboxylic acid
CID 113493885
5-[2-(4-methylpiperazin-1-yl)ethylsulfamoyl]furan-2-carboxylic acid
CID 60924480
5-[(1-methylsulfanylcyclopropyl)methylsulfamoyl]furan-2-carboxylic acid
CID 114115798
5-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylsulfamoyl]furan-2-carboxylic acid
CID 104932979
5-[(2-propylphenyl)sulfamoyl]furan-2-carboxylic acid
CID 43707205

Frequently Asked Questions

What is the IUPAC name of 5-(ethylsulfamoyl)furan-2-carboxylic acid?
The IUPAC name of 5-(ethylsulfamoyl)furan-2-carboxylic acid (CID 43149834) is 5-(ethylsulfamoyl)furan-2-carboxylic acid.
What is the SMILES notation for 5-(ethylsulfamoyl)furan-2-carboxylic acid?
The canonical SMILES for 5-(ethylsulfamoyl)furan-2-carboxylic acid is CCNS(=O)(=O)c1ccc(C(=O)O)o1.
What is the InChIKey of 5-(ethylsulfamoyl)furan-2-carboxylic acid?
The InChIKey is ORADTNBBZPVRJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO5S/c1-2-8-14(11,12)6-4-3-5(13-6)7(9)10/h3-4,8H,2H2,1H3,(H,9,10).
What are the key properties of 5-(ethylsulfamoyl)furan-2-carboxylic acid?
5-(ethylsulfamoyl)furan-2-carboxylic acid has a molecular weight of 219.22 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylsulfamoyl)furan-2-carboxylic acid is sourced from PubChem (CID 43149834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).