3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid

C11H15NO5S2 — CID 106120509

IUPAC3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1S(=O)(=O)NCC1CCC(O)C1
InChIInChI=1S/C11H15NO5S2/c13-8-2-1-7(5-8)6-12-19(16,17)9-3-4-18-10(9)11(14)15/h3-4,7-8,12-13H,1-2,5-6H2,(H,14,15)
InChIKeyQBEOIERRHYHFHW-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.89
Rot. Bonds5

About 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid

3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid (PubChem CID 106120509) has the molecular formula C11H15NO5S2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid
PubChem CID106120509
Molecular FormulaC11H15NO5S2
Molecular Weight305.38 g/mol
Exact Mass305.04
IUPAC Name3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1S(=O)(=O)NCC1CCC(O)C1
InChIInChI=1S/C11H15NO5S2/c13-8-2-1-7(5-8)6-12-19(16,17)9-3-4-18-10(9)11(14)15/h3-4,7-8,12-13H,1-2,5-6H2,(H,14,15)
InChIKeyQBEOIERRHYHFHW-UHFFFAOYSA-N
XLogP0.89
TPSA103.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(3-hydroxycyclopentyl)methylsulfamoyl]-5-methylfuran-2-carboxylic acid
CID 106120479
2-amino-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 103270335
3-(2,2-dimethylpropylsulfamoyl)thiophene-2-carboxylic acid
CID 61167041
3-[[(3-hydroxycyclohexyl)methylamino]methyl]thiophene-2-carboxylic acid
CID 106137034
2-[5-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophen-2-yl]acetic acid
CID 106120467
3-(pyridin-4-ylmethylsulfamoyl)thiophene-2-carboxylic acid
CID 17221138
3-amino-2,4-dichloro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 106119157
3-(hydroxysulfamoyl)thiophene-2-carboxylic acid
CID 115279685
4-chloro-N-[(3-hydroxycyclopentyl)methyl]benzenesulfonamide
CID 54351747
3-(butylsulfamoyl)thiophene-2-carboxylic acid
CID 17221125
3-(2,2,3,3-tetrafluoropropylsulfamoyl)thiophene-2-carboxylic acid
CID 114169173
N-[(3-hydroxycyclopentyl)methyl]-2-nitrobenzenesulfonamide
CID 103270198

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid?
The IUPAC name of 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid (CID 106120509) is 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid.
What is the SMILES notation for 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid?
The canonical SMILES for 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid is O=C(O)c1sccc1S(=O)(=O)NCC1CCC(O)C1.
What is the InChIKey of 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid?
The InChIKey is QBEOIERRHYHFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO5S2/c13-8-2-1-7(5-8)6-12-19(16,17)9-3-4-18-10(9)11(14)15/h3-4,7-8,12-13H,1-2,5-6H2,(H,14,15).
What are the key properties of 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid?
3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid has a molecular weight of 305.38 g/mol, XLogP of 0.89, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophene-2-carboxylic acid is sourced from PubChem (CID 106120509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).