2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid

C7H12N2O4S2 — CID 114958892

IUPAC2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid
SMILESNS(=O)(=O)N1C(C(=O)O)CSC1C1CC1
InChIInChI=1S/C7H12N2O4S2/c8-15(12,13)9-5(7(10)11)3-14-6(9)4-1-2-4/h4-6H,1-3H2,(H,10,11)(H2,8,12,13)
InChIKeyJZIINTSKPBVVSK-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.57
Rot. Bonds3

About 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid

2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid (PubChem CID 114958892) has the molecular formula C7H12N2O4S2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid
PubChem CID114958892
Molecular FormulaC7H12N2O4S2
Molecular Weight252.32 g/mol
Exact Mass252.02
IUPAC Name2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid
SMILESNS(=O)(=O)N1C(C(=O)O)CSC1C1CC1
InChIInChI=1S/C7H12N2O4S2/c8-15(12,13)9-5(7(10)11)3-14-6(9)4-1-2-4/h4-6H,1-3H2,(H,10,11)(H2,8,12,13)
InChIKeyJZIINTSKPBVVSK-UHFFFAOYSA-N
XLogP-0.57
TPSA100.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-3-(2-methoxyethylsulfonyl)-1,3-thiazolidine-4-carboxylic acid
CID 55235918
2-cyclopropyl-3-(1-methylpyrazol-4-yl)sulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 63781185
2-cyclopropyl-3-(2,5-dibromothiophen-3-yl)sulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 63781514
2-propyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid
CID 114958890
2-cyclopropyl-3-[(3-fluoro-2-pyridinyl)sulfonyl]-1,3-thiazolidine-4-carboxylic acid
CID 103298807
3-[2-(1-aminocyclobutyl)acetyl]-2-cyclopropyl-1,3-thiazolidine-4-carboxylic acid
CID 79853620
2-cyclopropyl-3-propan-2-yloxycarbonyl-1,3-thiazolidine-4-carboxylic acid
CID 63782007
2-ethyl-3-ethylsulfonyl-1,3-thiazolidine-4-carboxylic acid
CID 63781857
2-cyclopropyl-3-(ethylcarbamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 63792239
3-(2-cyclohexylacetyl)-2-cyclopropyl-1,3-thiazolidine-4-carboxylic acid
CID 63782130
3-(difluoromethylsulfonyl)-2-methyl-1,3-thiazolidine-4-carboxylic acid
CID 63781667
3-[(2S)-2-amino-4-methylpentanoyl]-2-cyclopropyl-1,3-thiazolidine-4-carboxylic acid
CID 55237260

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid (CID 114958892) is 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid is NS(=O)(=O)N1C(C(=O)O)CSC1C1CC1.
What is the InChIKey of 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is JZIINTSKPBVVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O4S2/c8-15(12,13)9-5(7(10)11)3-14-6(9)4-1-2-4/h4-6H,1-3H2,(H,10,11)(H2,8,12,13).
What are the key properties of 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid?
2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 252.32 g/mol, XLogP of -0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-sulfamoyl-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 114958892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).