ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate

C17H20N2O5S — CID 1192514

IUPACethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(NC(=O)COc2ccccc2OCC)n1
InChIInChI=1S/C17H20N2O5S/c1-3-22-13-7-5-6-8-14(13)24-10-15(20)19-17-18-12(11-25-17)9-16(21)23-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19,20)
InChIKeyAAQHMVJOXUCAKF-UHFFFAOYSA-N
MW364.42 g/mol
LogP2.66
Rot. Bonds9

About ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate

ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate (PubChem CID 1192514) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate
PubChem CID1192514
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Nameethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(NC(=O)COc2ccccc2OCC)n1
InChIInChI=1S/C17H20N2O5S/c1-3-22-13-7-5-6-8-14(13)24-10-15(20)19-17-18-12(11-25-17)9-16(21)23-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19,20)
InChIKeyAAQHMVJOXUCAKF-UHFFFAOYSA-N
XLogP2.66
TPSA86.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate with MolForge

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Related Compounds

N-(4,5-Dimethyl-thiazol-2-yl)-2-(2-methoxy-phenoxy)-acetamide
CID 893843
Ethyl (2-{[(3-methylphenoxy)acetyl]amino}-1,3-thiazol-4-yl)acetate
CID 699676
Ethyl (2-{[(4-methylphenoxy)acetyl]amino}-1,3-thiazol-4-yl)acetate
CID 2066145
N-[4-(2,3-Dihydro-benzo[1,4]dioxin-2-yl)-thiazol-2-yl]-acetamide
CID 3155495
4-Methyl-2-(2-phenoxy-acetylamino)-thiazole-5-carboxylic acid methyl ester
CID 647925
{2-[3-(4-Methoxy-phenyl)-acryloylamino]-thiazol-4-yl}-acetic acid ethyl ester
CID 707195
Methyl 2-[2-(2-methoxyphenoxy)acetamido]-4-methyl-1,3-thiazole-5-carboxylate
CID 805985
{2-[2-(4-Methoxy-phenoxy)-acetylamino]-thiazol-4-yl}-acetic acid ethyl ester
CID 986301
Ethyl 2-[2-[(2-phenoxyacetyl)amino]-1,3-thiazol-4-yl]acetate
CID 2066144
N-(4-methyl-2-thiazolyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide
CID 9551872
2-(2-methoxyphenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
CID 735180
N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]acetamide
CID 2940526

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate?
The IUPAC name of ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate (CID 1192514) is ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate.
What is the SMILES notation for ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate?
The canonical SMILES for ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate is CCOC(=O)Cc1csc(NC(=O)COc2ccccc2OCC)n1.
What is the InChIKey of ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate?
The InChIKey is AAQHMVJOXUCAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-3-22-13-7-5-6-8-14(13)24-10-15(20)19-17-18-12(11-25-17)9-16(21)23-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19,20).
What are the key properties of ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate?
ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate has a molecular weight of 364.42 g/mol, XLogP of 2.66, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]-1,3-thiazol-4-yl]acetate is sourced from PubChem (CID 1192514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).