ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate

C14H15NO3S — CID 15336769

IUPACethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(-c2ccccc2OC)n1
InChIInChI=1S/C14H15NO3S/c1-3-18-13(16)8-10-9-19-14(15-10)11-6-4-5-7-12(11)17-2/h4-7,9H,3,8H2,1-2H3
InChIKeyZCISXHHPGPRVEV-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.92
Rot. Bonds5

About ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate

ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate (PubChem CID 15336769) has the molecular formula C14H15NO3S and a molecular weight of 277.35 g/mol. Its IUPAC name is ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
PubChem CID15336769
Molecular FormulaC14H15NO3S
Molecular Weight277.35 g/mol
Exact Mass277.08
IUPAC Nameethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(-c2ccccc2OC)n1
InChIInChI=1S/C14H15NO3S/c1-3-18-13(16)8-10-9-19-14(15-10)11-6-4-5-7-12(11)17-2/h4-7,9H,3,8H2,1-2H3
InChIKeyZCISXHHPGPRVEV-UHFFFAOYSA-N
XLogP2.92
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[2-(2-methylphenyl)-1,3-thiazol-4-yl]acetate
CID 78908719
ethyl 2-[2-[2-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]acetate
CID 80573515
ethyl 2-[2-(2,3-dimethylphenyl)-1,3-thiazol-4-yl]acetate
CID 80573399
[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl] 2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 55507015
ethyl 3-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propanoate
CID 103485086
[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methyl 2-ethoxybenzoate
CID 16523884
ethyl 2-[2-(2-bromo-4-chloro-5-methoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 134588772
ethyl 2-[2-(4-fluoro-2-methylphenyl)-1,3-thiazol-4-yl]acetate
CID 81273605
ethyl 2-[2-(4-methylthiophen-3-yl)-1,3-thiazol-4-yl]acetate
CID 80574122
ethyl 2-(2-quinolin-2-yl-1,3-thiazol-4-yl)acetate
CID 80573402
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 16596855
N-[2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]ethyl]-2-methylpropanamide
CID 110317372

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate?
The IUPAC name of ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate (CID 15336769) is ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate.
What is the SMILES notation for ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate?
The canonical SMILES for ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate is CCOC(=O)Cc1csc(-c2ccccc2OC)n1.
What is the InChIKey of ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate?
The InChIKey is ZCISXHHPGPRVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S/c1-3-18-13(16)8-10-9-19-14(15-10)11-6-4-5-7-12(11)17-2/h4-7,9H,3,8H2,1-2H3.
What are the key properties of ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate?
ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate has a molecular weight of 277.35 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate is sourced from PubChem (CID 15336769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).