5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid

C11H15NO4S2 — CID 63281765

IUPAC5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid
SMILESCC1CCCC1NS(=O)(=O)c1ccc(C(=O)O)s1
InChIInChI=1S/C11H15NO4S2/c1-7-3-2-4-8(7)12-18(15,16)10-6-5-9(17-10)11(13)14/h5-8,12H,2-4H2,1H3,(H,13,14)
InChIKeySTQFJKYPPJFRRC-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.91
Rot. Bonds4

About 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid

5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid (PubChem CID 63281765) has the molecular formula C11H15NO4S2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid
PubChem CID63281765
Molecular FormulaC11H15NO4S2
Molecular Weight289.38 g/mol
Exact Mass289.04
IUPAC Name5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid
SMILESCC1CCCC1NS(=O)(=O)c1ccc(C(=O)O)s1
InChIInChI=1S/C11H15NO4S2/c1-7-3-2-4-8(7)12-18(15,16)10-6-5-9(17-10)11(13)14/h5-8,12H,2-4H2,1H3,(H,13,14)
InChIKeySTQFJKYPPJFRRC-UHFFFAOYSA-N
XLogP1.91
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid?
The IUPAC name of 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid (CID 63281765) is 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid.
What is the SMILES notation for 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid?
The canonical SMILES for 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid is CC1CCCC1NS(=O)(=O)c1ccc(C(=O)O)s1.
What is the InChIKey of 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid?
The InChIKey is STQFJKYPPJFRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4S2/c1-7-3-2-4-8(7)12-18(15,16)10-6-5-9(17-10)11(13)14/h5-8,12H,2-4H2,1H3,(H,13,14).
What are the key properties of 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid?
5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid has a molecular weight of 289.38 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylcyclopentyl)sulfamoyl]thiophene-2-carboxylic acid is sourced from PubChem (CID 63281765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).