3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid

C6H10N2O3S — CID 19823291

IUPAC3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid
SMILESNCC(=O)N1CSCC1C(=O)O
InChIInChI=1S/C6H10N2O3S/c7-1-5(9)8-3-12-2-4(8)6(10)11/h4H,1-3,7H2,(H,10,11)
InChIKeyRRRGIFISXYCWLG-UHFFFAOYSA-N
MW190.22 g/mol
LogP-1.07
Rot. Bonds2

About 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid

3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid (PubChem CID 19823291) has the molecular formula C6H10N2O3S and a molecular weight of 190.22 g/mol. Its IUPAC name is 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid
PubChem CID19823291
Molecular FormulaC6H10N2O3S
Molecular Weight190.22 g/mol
Exact Mass190.04
IUPAC Name3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid
SMILESNCC(=O)N1CSCC1C(=O)O
InChIInChI=1S/C6H10N2O3S/c7-1-5(9)8-3-12-2-4(8)6(10)11/h4H,1-3,7H2,(H,10,11)
InChIKeyRRRGIFISXYCWLG-UHFFFAOYSA-N
XLogP-1.07
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Procysteine
CID 72390
4-Thiazolidinecarboxylic acid, 3-acetyl-
CID 98928
2-Oxo-1,3-thiazolidine-4-carboxylic acid
CID 65272
(4R)-3-Acetyl-4-thiazolidinecarboxylic acid
CID 197107
2-[[(4R)-2-oxothiazolidine-4-carbonyl]amino]acetic acid
CID 477573
3-Glycyl-2-methyl-1,3-thiazolidine-4-carboxylic acid--hydrogen bromide (1/1)
CID 3065224
Cartasteine
CID 193952
(4R)-3-(3-Sulfanylpropanoyl)-1,3-thiazolidine-4-carboxylic acid
CID 12889987
N-(2-Methyl-1,3-thiazolidine-4-carbonyl)glycine
CID 53948971
(4S)-2-oxo-1,3-thiazolidine-4-carboxylic acid
CID 7075248
2-[2-amino-N-methyl-3-(methylsulfanyl)propanamido]acetic acid hydrochloride
CID 146049696
Glycine, N-[(2-oxo-4-thiazolidinyl)carbonyl]-
CID 9813095

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid (CID 19823291) is 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid is NCC(=O)N1CSCC1C(=O)O.
What is the InChIKey of 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is RRRGIFISXYCWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3S/c7-1-5(9)8-3-12-2-4(8)6(10)11/h4H,1-3,7H2,(H,10,11).
What are the key properties of 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid?
3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 190.22 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoacetyl)-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 19823291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).