2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid

C10H12N2O5S2 — CID 106185258

IUPAC2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid
SMILESO=C(O)Cc1ccc(S(=O)(=O)NC2CNC(=O)C2)s1
InChIInChI=1S/C10H12N2O5S2/c13-8-3-6(5-11-8)12-19(16,17)10-2-1-7(18-10)4-9(14)15/h1-2,6,12H,3-5H2,(H,11,13)(H,14,15)
InChIKeyQUHIRSURWBYNRK-UHFFFAOYSA-N
MW304.35 g/mol
LogP-0.46
Rot. Bonds5

About 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid

2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid (PubChem CID 106185258) has the molecular formula C10H12N2O5S2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid.

Molecular Properties

Compound Name2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid
PubChem CID106185258
Molecular FormulaC10H12N2O5S2
Molecular Weight304.35 g/mol
Exact Mass304.02
IUPAC Name2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid
SMILESO=C(O)Cc1ccc(S(=O)(=O)NC2CNC(=O)C2)s1
InChIInChI=1S/C10H12N2O5S2/c13-8-3-6(5-11-8)12-19(16,17)10-2-1-7(18-10)4-9(14)15/h1-2,6,12H,3-5H2,(H,11,13)(H,14,15)
InChIKeyQUHIRSURWBYNRK-UHFFFAOYSA-N
XLogP-0.46
TPSA112.57 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-[(6-oxopiperidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid
CID 63661363
2-[5-[(3-methylcyclobutyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 113467124
5-[(6-oxopiperidin-3-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 63662251
2-[5-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]thiophen-2-yl]acetic acid
CID 107216240
2-[5-[[2-(hydroxymethyl)cyclopentyl]sulfamoyl]thiophen-2-yl]acetic acid
CID 106359332
2-[5-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 114628923
5-bromo-4-methyl-N-(5-oxopyrrolidin-3-yl)thiophene-2-sulfonamide
CID 104696894
2-[5-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]thiophen-2-yl]acetic acid
CID 29267010
2-[5-(1H-imidazol-2-ylmethylsulfamoyl)thiophen-2-yl]acetic acid
CID 64548410
2-[5-[(3-hydroxycyclopentyl)methylsulfamoyl]thiophen-2-yl]acetic acid
CID 106120467
4-[(5-ethylthiophen-2-yl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 61454626
N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009

Frequently Asked Questions

What is the IUPAC name of 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid?
The IUPAC name of 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid (CID 106185258) is 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid.
What is the SMILES notation for 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid?
The canonical SMILES for 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid is O=C(O)Cc1ccc(S(=O)(=O)NC2CNC(=O)C2)s1.
What is the InChIKey of 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid?
The InChIKey is QUHIRSURWBYNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O5S2/c13-8-3-6(5-11-8)12-19(16,17)10-2-1-7(18-10)4-9(14)15/h1-2,6,12H,3-5H2,(H,11,13)(H,14,15).
What are the key properties of 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid?
2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid has a molecular weight of 304.35 g/mol, XLogP of -0.46, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(5-oxopyrrolidin-3-yl)sulfamoyl]thiophen-2-yl]acetic acid is sourced from PubChem (CID 106185258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).