2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide

C13H15N3O2S — CID 62800309

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide
SMILESCCOc1cccc(NC(=O)Cc2csc(N)n2)c1
InChIInChI=1S/C13H15N3O2S/c1-2-18-11-5-3-4-9(6-11)15-12(17)7-10-8-19-13(14)16-10/h3-6,8H,2,7H2,1H3,(H2,14,16)(H,15,17)
InChIKeyOQMVHJFAXUIYID-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.31
Rot. Bonds5

About 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide (PubChem CID 62800309) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide
PubChem CID62800309
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide
SMILESCCOc1cccc(NC(=O)Cc2csc(N)n2)c1
InChIInChI=1S/C13H15N3O2S/c1-2-18-11-5-3-4-9(6-11)15-12(17)7-10-8-19-13(14)16-10/h3-6,8H,2,7H2,1H3,(H2,14,16)(H,15,17)
InChIKeyOQMVHJFAXUIYID-UHFFFAOYSA-N
XLogP2.31
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-amino-1,3-thiazol-4-yl)-N-(3-chlorophenyl)acetamide
CID 55120912
2-(2-amino-1,3-thiazol-4-yl)-N-[3-(methoxymethyl)phenyl]acetamide
CID 62799415
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]benzoic acid
CID 55120222
3-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-N-ethylbenzamide
CID 62799063
N-(3-acetamidophenyl)-2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 46584283
2-(2-amino-1,3-thiazol-4-yl)-N-pyridin-4-ylacetamide
CID 62795383
ethyl 3-[[2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]benzoate
CID 39631537
2-(2-anilino-1,3-thiazol-4-yl)-N-(4-ethoxyphenyl)acetamide
CID 27377773
2-(2-acetamido-1,3-thiazol-4-yl)-N-(4-ethoxyphenyl)acetamide
CID 18568208
2-(aminomethyl)-N-(3-ethoxyphenyl)-1,3-thiazole-4-carboxamide
CID 66378221
2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
CID 66351961
2-(2-amino-1,3-thiazol-4-yl)-N-(6-methylsulfonyl-3-pyridinyl)acetamide
CID 62797643

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide (CID 62800309) is 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide is CCOc1cccc(NC(=O)Cc2csc(N)n2)c1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide?
The InChIKey is OQMVHJFAXUIYID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-2-18-11-5-3-4-9(6-11)15-12(17)7-10-8-19-13(14)16-10/h3-6,8H,2,7H2,1H3,(H2,14,16)(H,15,17).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide has a molecular weight of 277.35 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(3-ethoxyphenyl)acetamide is sourced from PubChem (CID 62800309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).