2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

C9H15N3O2S — CID 3229598

IUPAC2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCOCCNCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C9H15N3O2S/c1-7-5-11-9(15-7)12-8(13)6-10-3-4-14-2/h5,10H,3-4,6H2,1-2H3,(H,11,12,13)
InChIKeyWYZJNAURMCDHMA-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.63
Rot. Bonds6

About 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide

2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 3229598) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID3229598
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
SMILESCOCCNCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C9H15N3O2S/c1-7-5-11-9(15-7)12-8(13)6-10-3-4-14-2/h5,10H,3-4,6H2,1-2H3,(H,11,12,13)
InChIKeyWYZJNAURMCDHMA-UHFFFAOYSA-N
XLogP0.63
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide (CID 3229598) is 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is COCCNCC(=O)Nc1ncc(C)s1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is WYZJNAURMCDHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-7-5-11-9(15-7)12-8(13)6-10-3-4-14-2/h5,10H,3-4,6H2,1-2H3,(H,11,12,13).
What are the key properties of 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide?
2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 229.30 g/mol, XLogP of 0.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 3229598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).