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

C7H11N3O2S — CID 174581860

IUPACN-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide
SMILESCCON(C(C)=O)c1csc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-3-12-10(5(2)11)6-4-13-7(8)9-6/h4H,3H2,1-2H3,(H2,8,9)
InChIKeyUJHLOLQGRRJMQE-UHFFFAOYSA-N
MW201.25 g/mol
LogP1.03
Rot. Bonds3

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

N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide (PubChem CID 174581860) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide.

Molecular Properties

Compound NameN-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide
PubChem CID174581860
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC NameN-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide
SMILESCCON(C(C)=O)c1csc(N)n1
InChIInChI=1S/C7H11N3O2S/c1-3-12-10(5(2)11)6-4-13-7(8)9-6/h4H,3H2,1-2H3,(H2,8,9)
InChIKeyUJHLOLQGRRJMQE-UHFFFAOYSA-N
XLogP1.03
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(2-amino-1,3-thiazol-4-yl)-3-ethoxybutan-2-one
CID 174520084
acetic acid;tris(4-ethyl-1,3-thiazol-2-amine)
CID 173153334
1-(2-amino-1,3-thiazol-4-yl)ethanone
CID 3111964
ethyl 2-amino-1,3-thiazole-4-carboxylate;ethyl 2-bromo-1,3-thiazole-4-carboxylate
CID 158338935
1-(2-amino-1,3-thiazol-4-yl)propan-2-one
CID 22977217
2-amino-N-methyl-N-pentan-3-yl-1,3-thiazole-4-carboxamide
CID 62789071
ethyl 2-(2-amino-1,3-thiazol-4-yl)-2-ethylbutanoate
CID 138673569
chloro 2-(2-amino-1,3-thiazol-4-yl)butanoate
CID 174643774
(2-amino-1,3-thiazol-4-yl) propanoate;hydrochloride
CID 87957803
propyl 2-amino-1,3-thiazole-4-carboxylate
CID 58670395
1-(2-amino-1,3-thiazol-4-yl)butan-1-one
CID 13040576
N-[(2-amino-1,3-thiazol-4-yl)methyl]acetamide
CID 110717958

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide?
The IUPAC name of N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide (CID 174581860) is N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide.
What is the SMILES notation for N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide?
The canonical SMILES for N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide is CCON(C(C)=O)c1csc(N)n1.
What is the InChIKey of N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide?
The InChIKey is UJHLOLQGRRJMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-3-12-10(5(2)11)6-4-13-7(8)9-6/h4H,3H2,1-2H3,(H2,8,9).
What are the key properties of N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide?
N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide has a molecular weight of 201.25 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1,3-thiazol-4-yl)-N-ethoxyacetamide is sourced from PubChem (CID 174581860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).