4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one

C6H9NO3S — CID 123383007

IUPAC4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one
SMILESCOCCn1c(O)csc1=O
InChIInChI=1S/C6H9NO3S/c1-10-3-2-7-5(8)4-11-6(7)9/h4,8H,2-3H2,1H3
InChIKeyPNEFGLONAHUQQT-UHFFFAOYSA-N
MW175.21 g/mol
LogP0.26
Rot. Bonds3

About 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one

4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one (PubChem CID 123383007) has the molecular formula C6H9NO3S and a molecular weight of 175.21 g/mol. Its IUPAC name is 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one
PubChem CID123383007
Molecular FormulaC6H9NO3S
Molecular Weight175.21 g/mol
Exact Mass175.03
IUPAC Name4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one
SMILESCOCCn1c(O)csc1=O
InChIInChI=1S/C6H9NO3S/c1-10-3-2-7-5(8)4-11-6(7)9/h4,8H,2-3H2,1H3
InChIKeyPNEFGLONAHUQQT-UHFFFAOYSA-N
XLogP0.26
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-Hydroxy-3-(3-methoxypropyl)-1,3-thiazol-2-one
CID 54426525
3-(2-Hydroxyethyl)-1,3-thiazol-2-one
CID 63312361
4-Hydroxy-3-(2-hydroxyethyl)-1,3-thiazol-2-one
CID 123424852
3-(2-Propoxyethyl)-1,3-thiazol-2-one
CID 106458071
3-(2-Methoxyethyl)-1,3-thiazol-2-one
CID 115646842
3-(2-Ethoxyethyl)-1,3-thiazol-2-one
CID 115749770

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one?
The IUPAC name of 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one (CID 123383007) is 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one?
The canonical SMILES for 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one is COCCn1c(O)csc1=O.
What is the InChIKey of 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one?
The InChIKey is PNEFGLONAHUQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3S/c1-10-3-2-7-5(8)4-11-6(7)9/h4,8H,2-3H2,1H3.
What are the key properties of 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one?
4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one has a molecular weight of 175.21 g/mol, XLogP of 0.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 123383007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).