1-[(4R)-1,3-thiazolidin-4-yl]ethenol

C5H9NOS — CID 118586381

IUPAC1-[(4R)-1,3-thiazolidin-4-yl]ethenol
SMILESC=C(O)[C@@H]1CSCN1
InChIInChI=1S/C5H9NOS/c1-4(7)5-2-8-3-6-5/h5-7H,1-3H2/t5-/m0/s1
InChIKeyCJEBDFUQCPMGPF-YFKPBYRVSA-N
MW131.20 g/mol
LogP0.72
Rot. Bonds1

About 1-[(4R)-1,3-thiazolidin-4-yl]ethenol

1-[(4R)-1,3-thiazolidin-4-yl]ethenol (PubChem CID 118586381) has the molecular formula C5H9NOS and a molecular weight of 131.20 g/mol. Its IUPAC name is 1-[(4R)-1,3-thiazolidin-4-yl]ethenol.

Molecular Properties

Compound Name1-[(4R)-1,3-thiazolidin-4-yl]ethenol
PubChem CID118586381
Molecular FormulaC5H9NOS
Molecular Weight131.20 g/mol
Exact Mass131.04
IUPAC Name1-[(4R)-1,3-thiazolidin-4-yl]ethenol
SMILESC=C(O)[C@@H]1CSCN1
InChIInChI=1S/C5H9NOS/c1-4(7)5-2-8-3-6-5/h5-7H,1-3H2/t5-/m0/s1
InChIKeyCJEBDFUQCPMGPF-YFKPBYRVSA-N
XLogP0.72
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1,3-thiazolidine-4-carboxylic acid
CID 9934
1,3-thiazolidine-4-carboxylic acid;2,2,2-trifluoroacetic acid
CID 172787478
N-ethyl-N-hydroxy-1,3-thiazolidine-4-carboxamide
CID 131080910
2-[[(4R)-1,3-thiazolidine-4-carbonyl](15N)amino]acetic acid
CID 171381409
1-(1,3-thiazolidine-4-carbonyl)azetidine-3-carboxylic acid
CID 79310155
2-[cyclopropyl(1,3-thiazolidine-4-carbonyl)amino]acetic acid
CID 61161099
N-cyclopropyl-N-(2-hydroxyethyl)-1,3-thiazolidine-4-carboxamide
CID 43579611
(4R)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid;(4R)-1,3-thiazolidine-4-carboxylic acid
CID 159429720
(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 130718908
N-tert-butyl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 47003078
N-methoxy-N-methyl-1,3-thiazolidine-4-carboxamide
CID 22922472
(2R)-1-(1,3-thiazolidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 78923109

Frequently Asked Questions

What is the IUPAC name of 1-[(4R)-1,3-thiazolidin-4-yl]ethenol?
The IUPAC name of 1-[(4R)-1,3-thiazolidin-4-yl]ethenol (CID 118586381) is 1-[(4R)-1,3-thiazolidin-4-yl]ethenol.
What is the SMILES notation for 1-[(4R)-1,3-thiazolidin-4-yl]ethenol?
The canonical SMILES for 1-[(4R)-1,3-thiazolidin-4-yl]ethenol is C=C(O)[C@@H]1CSCN1.
What is the InChIKey of 1-[(4R)-1,3-thiazolidin-4-yl]ethenol?
The InChIKey is CJEBDFUQCPMGPF-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H9NOS/c1-4(7)5-2-8-3-6-5/h5-7H,1-3H2/t5-/m0/s1.
What are the key properties of 1-[(4R)-1,3-thiazolidin-4-yl]ethenol?
1-[(4R)-1,3-thiazolidin-4-yl]ethenol has a molecular weight of 131.20 g/mol, XLogP of 0.72, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4R)-1,3-thiazolidin-4-yl]ethenol is sourced from PubChem (CID 118586381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).