2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid

C8H10N2O4S — CID 43354501

IUPAC2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid
SMILESCc1csc(=O)n1CC(=O)NCC(=O)O
InChIInChI=1S/C8H10N2O4S/c1-5-4-15-8(14)10(5)3-6(11)9-2-7(12)13/h4H,2-3H2,1H3,(H,9,11)(H,12,13)
InChIKeyRYORUIRSDVINRO-UHFFFAOYSA-N
MW230.24 g/mol
LogP-0.58
Rot. Bonds4

About 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid

2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid (PubChem CID 43354501) has the molecular formula C8H10N2O4S and a molecular weight of 230.24 g/mol. Its IUPAC name is 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid
PubChem CID43354501
Molecular FormulaC8H10N2O4S
Molecular Weight230.24 g/mol
Exact Mass230.04
IUPAC Name2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid
SMILESCc1csc(=O)n1CC(=O)NCC(=O)O
InChIInChI=1S/C8H10N2O4S/c1-5-4-15-8(14)10(5)3-6(11)9-2-7(12)13/h4H,2-3H2,1H3,(H,9,11)(H,12,13)
InChIKeyRYORUIRSDVINRO-UHFFFAOYSA-N
XLogP-0.58
TPSA88.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid (CID 43354501) is 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid is Cc1csc(=O)n1CC(=O)NCC(=O)O.
What is the InChIKey of 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid?
The InChIKey is RYORUIRSDVINRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O4S/c1-5-4-15-8(14)10(5)3-6(11)9-2-7(12)13/h4H,2-3H2,1H3,(H,9,11)(H,12,13).
What are the key properties of 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid?
2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid has a molecular weight of 230.24 g/mol, XLogP of -0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid is sourced from PubChem (CID 43354501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).