ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate

C19H18N2O4S — CID 3146020

IUPACethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(NC(=O)COc2ccc3ccccc3c2)n1
InChIInChI=1S/C19H18N2O4S/c1-2-24-18(23)10-15-12-26-19(20-15)21-17(22)11-25-16-8-7-13-5-3-4-6-14(13)9-16/h3-9,12H,2,10-11H2,1H3,(H,20,21,22)
InChIKeyNHFJDFPALCFZLB-UHFFFAOYSA-N
MW370.43 g/mol
LogP3.42
Rot. Bonds7

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

ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate (PubChem CID 3146020) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate
PubChem CID3146020
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC Nameethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate
SMILESCCOC(=O)Cc1csc(NC(=O)COc2ccc3ccccc3c2)n1
InChIInChI=1S/C19H18N2O4S/c1-2-24-18(23)10-15-12-26-19(20-15)21-17(22)11-25-16-8-7-13-5-3-4-6-14(13)9-16/h3-9,12H,2,10-11H2,1H3,(H,20,21,22)
InChIKeyNHFJDFPALCFZLB-UHFFFAOYSA-N
XLogP3.42
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

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
Ethyl 2-[2-[(4-oxochromene-2-carbonyl)amino]-1,3-thiazol-4-yl]acetate
CID 3548924
4-[(2-Naphthyloxy)methyl]-1,3-thiazol-2-amine
CID 973573
Ethyl 2-{[(4-tert-butylphenoxy)acetyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
CID 978479
{2-[3-(4-Methoxy-phenyl)-acryloylamino]-thiazol-4-yl}-acetic acid ethyl ester
CID 707195
{2-[2-(4-Methoxy-phenoxy)-acetylamino]-thiazol-4-yl}-acetic acid ethyl ester
CID 986301
ethyl 2-(2-(2-((4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)thiazol-4-yl)acetate
CID 1078094
Methyl 4-methyl-2-[2-(naphthalen-1-yloxy)acetamido]-1,3-thiazole-5-carboxylate
CID 1317019
Ethyl 2-[2-[(2-phenoxyacetyl)amino]-1,3-thiazol-4-yl]acetate
CID 2066144
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 2679158
ethyl [2-({2-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}amino)-1,3-thiazol-4-yl]acetate
CID 2967769

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate?
The IUPAC name of ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate (CID 3146020) is ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate.
What is the SMILES notation for ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate?
The canonical SMILES for ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate is CCOC(=O)Cc1csc(NC(=O)COc2ccc3ccccc3c2)n1.
What is the InChIKey of ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate?
The InChIKey is NHFJDFPALCFZLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c1-2-24-18(23)10-15-12-26-19(20-15)21-17(22)11-25-16-8-7-13-5-3-4-6-14(13)9-16/h3-9,12H,2,10-11H2,1H3,(H,20,21,22).
What are the key properties of ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate?
ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate has a molecular weight of 370.43 g/mol, XLogP of 3.42, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-[(2-naphthalen-2-yloxyacetyl)amino]-1,3-thiazol-4-yl]acetate is sourced from PubChem (CID 3146020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).