(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid

C9H10N2O2S — CID 6610570

IUPAC(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid
SMILESO=C(O)[C@@H]1CSC(c2cccnc2)N1
InChIInChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)/t7-,8?/m0/s1
InChIKeyFSNGLHIMQHWTNF-JAMMHHFISA-N
MW210.26 g/mol
LogP0.87
Rot. Bonds2

About (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid

(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid (PubChem CID 6610570) has the molecular formula C9H10N2O2S and a molecular weight of 210.26 g/mol. Its IUPAC name is (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid
PubChem CID6610570
Molecular FormulaC9H10N2O2S
Molecular Weight210.26 g/mol
Exact Mass210.05
IUPAC Name(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid
SMILESO=C(O)[C@@H]1CSC(c2cccnc2)N1
InChIInChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)/t7-,8?/m0/s1
InChIKeyFSNGLHIMQHWTNF-JAMMHHFISA-N
XLogP0.87
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic 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 (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid (CID 6610570) is (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid is O=C(O)[C@@H]1CSC(c2cccnc2)N1.
What is the InChIKey of (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is FSNGLHIMQHWTNF-JAMMHHFISA-N. The full InChI is InChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)/t7-,8?/m0/s1.
What are the key properties of (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid?
(4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 210.26 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-pyridin-3-yl-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 6610570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).