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

C10H13NO4S — CID 155133197

IUPACethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(C(=O)COC)n1
InChIInChI=1S/C10H13NO4S/c1-3-15-9(13)4-7-6-16-10(11-7)8(12)5-14-2/h6H,3-5H2,1-2H3
InChIKeyVIRZEMNKLNOZAG-UHFFFAOYSA-N
MW243.28 g/mol
LogP1.08
Rot. Bonds6

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

ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate (PubChem CID 155133197) has the molecular formula C10H13NO4S and a molecular weight of 243.28 g/mol. Its IUPAC name is ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate
PubChem CID155133197
Molecular FormulaC10H13NO4S
Molecular Weight243.28 g/mol
Exact Mass243.06
IUPAC Nameethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(C(=O)COC)n1
InChIInChI=1S/C10H13NO4S/c1-3-15-9(13)4-7-6-16-10(11-7)8(12)5-14-2/h6H,3-5H2,1-2H3
InChIKeyVIRZEMNKLNOZAG-UHFFFAOYSA-N
XLogP1.08
TPSA65.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-[2-[2-(4-methylpentan-2-yloxy)acetyl]-1,3-thiazol-4-yl]acetate
CID 134433741
ethyl 2-[2-[2-[4-(4-methylpentan-2-yl)phenoxy]acetyl]-1,3-thiazol-4-yl]acetate
CID 155133220
ethyl 2-(2-propan-2-yl-1,3-thiazol-4-yl)acetate
CID 10727325
ethyl 2-[2-(2-aminopropan-2-yl)-1,3-thiazol-4-yl]acetate
CID 107380027
ethyl 2-(2-acetamido-1,3-thiazol-4-yl)acetate
CID 3477732
ethyl 2-[2-(carbamothioylamino)-1,3-thiazol-4-yl]acetate
CID 16637409
ethyl 2-[2-[(2-methoxy-2-oxoethyl)amino]-1,3-thiazol-4-yl]acetate
CID 80575326
ethyl 2-[2-[[(2R)-1-methoxypropan-2-yl]amino]-1,3-thiazol-4-yl]acetate
CID 97170705
ethyl 2-[2-(3-aminopropyl)-1,3-thiazol-4-yl]acetate
CID 107380154
ethyl 2-[2-(4-methylthiophen-3-yl)-1,3-thiazol-4-yl]acetate
CID 80574122
ethyl 2-[2-(prop-2-enoylamino)-1,3-thiazol-4-yl]acetate
CID 43622982
[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl] 2-(2-methyl-1,3-thiazol-4-yl)acetate
CID 55328075

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate?
The IUPAC name of ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate (CID 155133197) is ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate.
What is the SMILES notation for ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate?
The canonical SMILES for ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate is CCOC(=O)Cc1csc(C(=O)COC)n1.
What is the InChIKey of ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate?
The InChIKey is VIRZEMNKLNOZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4S/c1-3-15-9(13)4-7-6-16-10(11-7)8(12)5-14-2/h6H,3-5H2,1-2H3.
What are the key properties of ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate?
ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate has a molecular weight of 243.28 g/mol, XLogP of 1.08, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-(2-methoxyacetyl)-1,3-thiazol-4-yl]acetate is sourced from PubChem (CID 155133197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).