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

C6H9NO2S — CID 115646842

IUPAC3-(2-methoxyethyl)-1,3-thiazol-2-one
SMILESCOCCn1ccsc1=O
InChIInChI=1S/C6H9NO2S/c1-9-4-2-7-3-5-10-6(7)8/h3,5H,2,4H2,1H3
InChIKeyUWJUXIGCXNAARE-UHFFFAOYSA-N
MW159.21 g/mol
LogP0.56
Rot. Bonds3

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

3-(2-methoxyethyl)-1,3-thiazol-2-one (PubChem CID 115646842) has the molecular formula C6H9NO2S and a molecular weight of 159.21 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1,3-thiazol-2-one
PubChem CID115646842
Molecular FormulaC6H9NO2S
Molecular Weight159.21 g/mol
Exact Mass159.04
IUPAC Name3-(2-methoxyethyl)-1,3-thiazol-2-one
SMILESCOCCn1ccsc1=O
InChIInChI=1S/C6H9NO2S/c1-9-4-2-7-3-5-10-6(7)8/h3,5H,2,4H2,1H3
InChIKeyUWJUXIGCXNAARE-UHFFFAOYSA-N
XLogP0.56
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.21
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(2,2,2-Trifluoroethoxy)ethyl]-1,3-thiazol-2-one
CID 115659269
3-[2-(Trifluoromethoxy)ethyl]-1,3-thiazol-2-one
CID 116622715
3-(2-ethoxyethyl)-2H-1,3-thiazole
CID 59866161
3-(2-Hydroxyethyl)-1,3-thiazol-2-one
CID 63312361
ethyl 2-methyl-2H-1,3-thiazole-3-carboxylate
CID 69174231
ethyl 2H-1,3-thiazole-3-carboxylate
CID 70119022
4-Hydroxy-3-(2-methoxyethyl)-1,3-thiazol-2-one
CID 123383007
Ethyl 2-(2-oxo-1,3-thiazol-3-yl)acetate
CID 63312394
3-(2,2-Dimethoxyethyl)-1,3-thiazol-2-one
CID 66222787
3-[2-(2-Sulfanylethoxy)ethyl]-1,3-thiazol-2-one
CID 80031214
4-(2-Methoxyethyl)-1,4-thiazin-3-one
CID 84406397
3-[2-(3-Methoxypropoxy)ethyl]-1,3-thiazol-2-one
CID 103184191

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1,3-thiazol-2-one?
The IUPAC name of 3-(2-methoxyethyl)-1,3-thiazol-2-one (CID 115646842) is 3-(2-methoxyethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 3-(2-methoxyethyl)-1,3-thiazol-2-one?
The canonical SMILES for 3-(2-methoxyethyl)-1,3-thiazol-2-one is COCCn1ccsc1=O.
What is the InChIKey of 3-(2-methoxyethyl)-1,3-thiazol-2-one?
The InChIKey is UWJUXIGCXNAARE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2S/c1-9-4-2-7-3-5-10-6(7)8/h3,5H,2,4H2,1H3.
What are the key properties of 3-(2-methoxyethyl)-1,3-thiazol-2-one?
3-(2-methoxyethyl)-1,3-thiazol-2-one has a molecular weight of 159.21 g/mol, XLogP of 0.56, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 115646842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).