4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one

C11H11NO2S — CID 43286764

IUPAC4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one
SMILESCCOc1ccccc1-c1csc(=O)[nH]1
InChIInChI=1S/C11H11NO2S/c1-2-14-10-6-4-3-5-8(10)9-7-15-11(13)12-9/h3-7H,2H2,1H3,(H,12,13)
InChIKeyCVUXSKWPQOJPSB-UHFFFAOYSA-N
MW221.28 g/mol
LogP2.50
Rot. Bonds3

About 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one

4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one (PubChem CID 43286764) has the molecular formula C11H11NO2S and a molecular weight of 221.28 g/mol. Its IUPAC name is 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one
PubChem CID43286764
Molecular FormulaC11H11NO2S
Molecular Weight221.28 g/mol
Exact Mass221.05
IUPAC Name4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one
SMILESCCOc1ccccc1-c1csc(=O)[nH]1
InChIInChI=1S/C11H11NO2S/c1-2-14-10-6-4-3-5-8(10)9-7-15-11(13)12-9/h3-7H,2H2,1H3,(H,12,13)
InChIKeyCVUXSKWPQOJPSB-UHFFFAOYSA-N
XLogP2.50
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-ethoxyphenyl)-3-(sulfanylmethyl)-1H-pyridin-2-one
CID 82518878
4-[2-(trifluoromethyl)phenyl]-3H-1,3-thiazol-2-one
CID 43286788
2-(2-ethoxyphenyl)-3H-pyrido[3,2-d]pyrimidin-4-one
CID 135670755
ethyl 3-amino-5-(2-ethoxyphenyl)-1H-pyrrole-2-carboxylate
CID 92715293
4-[[(3-ethoxy-2-pyridinyl)amino]methyl]-3H-1,3-thiazol-2-one
CID 106382213
2-(2-ethoxyphenyl)-1,3-thiazole-4-carboxylic acid
CID 43140171
3-[(butan-2-ylamino)methyl]-6-(2-ethoxyphenyl)-1H-pyridin-2-one
CID 82518886
4-(2-ethoxyphenyl)pyridine
CID 23466193
2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole
CID 112690146
1-ethoxy-2-[4-(4-phenylphenyl)phenyl]benzene
CID 151505413
2-(2-ethoxyphenyl)-1H-imidazole-5-carbaldehyde
CID 80502436
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propan-2-amine
CID 82516097

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one?
The IUPAC name of 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one (CID 43286764) is 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one.
What is the SMILES notation for 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one?
The canonical SMILES for 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one is CCOc1ccccc1-c1csc(=O)[nH]1.
What is the InChIKey of 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one?
The InChIKey is CVUXSKWPQOJPSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2S/c1-2-14-10-6-4-3-5-8(10)9-7-15-11(13)12-9/h3-7H,2H2,1H3,(H,12,13).
What are the key properties of 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one?
4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one has a molecular weight of 221.28 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenyl)-3H-1,3-thiazol-2-one is sourced from PubChem (CID 43286764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).