2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid

C11H16N2O4S — CID 43360305

IUPAC2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
SMILESCC(NC(=O)CN1CSCC1=O)(C(=O)O)C1CC1
InChIInChI=1S/C11H16N2O4S/c1-11(10(16)17,7-2-3-7)12-8(14)4-13-6-18-5-9(13)15/h7H,2-6H2,1H3,(H,12,14)(H,16,17)
InChIKeyRKPZVFJNGDJHLK-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.11
Rot. Bonds5

About 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid

2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid (PubChem CID 43360305) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
PubChem CID43360305
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
SMILESCC(NC(=O)CN1CSCC1=O)(C(=O)O)C1CC1
InChIInChI=1S/C11H16N2O4S/c1-11(10(16)17,7-2-3-7)12-8(14)4-13-6-18-5-9(13)15/h7H,2-6H2,1H3,(H,12,14)(H,16,17)
InChIKeyRKPZVFJNGDJHLK-UHFFFAOYSA-N
XLogP-0.11
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid with MolForge

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Related Compounds

N-(1-hydroxy-2-methylbutan-2-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 64556996
N-(1-tert-butylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47341054
2-cyclopropyl-2-[(2-piperazin-1-ylacetyl)amino]propanoic acid
CID 61162529
N-[3-(aminomethyl)pentan-3-yl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide;hydrochloride
CID 119571783
N'-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]cyclopropanecarbohydrazide
CID 51110368
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]acetic acid
CID 43170515
N-(1-acetylpiperidin-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 47116849
N-(3-methylcyclopentyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 114549925
2-cyclopropyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]propanoic acid
CID 43360373
3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid
CID 43354693
N-(4-aminocyclohexyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 119478713
2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]butanoic acid
CID 43469224

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid?
The IUPAC name of 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid (CID 43360305) is 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid.
What is the SMILES notation for 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid?
The canonical SMILES for 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid is CC(NC(=O)CN1CSCC1=O)(C(=O)O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid?
The InChIKey is RKPZVFJNGDJHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-11(10(16)17,7-2-3-7)12-8(14)4-13-6-18-5-9(13)15/h7H,2-6H2,1H3,(H,12,14)(H,16,17).
What are the key properties of 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid?
2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid has a molecular weight of 272.33 g/mol, XLogP of -0.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanoic acid is sourced from PubChem (CID 43360305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).