5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid

C10H15NO5S — CID 43149833

IUPAC5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid
SMILESCCC(CC)NS(=O)(=O)c1ccc(C(=O)O)o1
InChIInChI=1S/C10H15NO5S/c1-3-7(4-2)11-17(14,15)9-6-5-8(16-9)10(12)13/h5-7,11H,3-4H2,1-2H3,(H,12,13)
InChIKeyZSLIIBNPPIKXGO-UHFFFAOYSA-N
MW261.30 g/mol
LogP1.44
Rot. Bonds6

About 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid

5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid (PubChem CID 43149833) has the molecular formula C10H15NO5S and a molecular weight of 261.30 g/mol. Its IUPAC name is 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid.

Molecular Properties

Compound Name5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid
PubChem CID43149833
Molecular FormulaC10H15NO5S
Molecular Weight261.30 g/mol
Exact Mass261.07
IUPAC Name5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid
SMILESCCC(CC)NS(=O)(=O)c1ccc(C(=O)O)o1
InChIInChI=1S/C10H15NO5S/c1-3-7(4-2)11-17(14,15)9-6-5-8(16-9)10(12)13/h5-7,11H,3-4H2,1-2H3,(H,12,13)
InChIKeyZSLIIBNPPIKXGO-UHFFFAOYSA-N
XLogP1.44
TPSA96.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(ethylsulfamoyl)furan-2-carboxylic acid
CID 43149834
5-[[(2S)-2-hydroxypropyl]sulfamoyl]furan-2-carboxylic acid
CID 107216107
5-(3-methylpentan-3-ylsulfamoyl)furan-2-carboxylic acid
CID 106328341
5-methyl-4-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid
CID 62803052
5-[[(1R)-1-(4-fluorophenyl)ethyl]sulfamoyl]furan-2-carboxylic acid
CID 81350795
5-(1-cyclohexylethylsulfamoyl)furan-2-carboxylic acid
CID 62406823
5-[butan-2-yl(methyl)sulfamoyl]furan-2-carboxylic acid
CID 43272665
5-[(3-ethoxycyclobutyl)sulfamoyl]furan-2-carboxylic acid
CID 114118892
5-[[(1S)-1-(3-methylphenyl)ethyl]sulfamoyl]furan-2-carboxylic acid
CID 81369021
5-[[(1S)-1-(3-bromophenyl)ethyl]sulfamoyl]furan-2-carboxylic acid
CID 81370759
ethyl 5-[(1-amino-4-methylpentan-2-yl)sulfamoyl]furan-2-carboxylate
CID 119983242
5-(2,2,2-trifluoroethylsulfamoyl)furan-2-carboxylic acid
CID 29077583

Frequently Asked Questions

What is the IUPAC name of 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid?
The IUPAC name of 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid (CID 43149833) is 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid.
What is the SMILES notation for 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid?
The canonical SMILES for 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid is CCC(CC)NS(=O)(=O)c1ccc(C(=O)O)o1.
What is the InChIKey of 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid?
The InChIKey is ZSLIIBNPPIKXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO5S/c1-3-7(4-2)11-17(14,15)9-6-5-8(16-9)10(12)13/h5-7,11H,3-4H2,1-2H3,(H,12,13).
What are the key properties of 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid?
5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid has a molecular weight of 261.30 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(pentan-3-ylsulfamoyl)furan-2-carboxylic acid is sourced from PubChem (CID 43149833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).