2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide

C11H15N3OS2 — CID 91829334

IUPAC2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide
SMILESCCSCC(=O)NC(C)c1cn2ccsc2n1
InChIInChI=1S/C11H15N3OS2/c1-3-16-7-10(15)12-8(2)9-6-14-4-5-17-11(14)13-9/h4-6,8H,3,7H2,1-2H3,(H,12,15)
InChIKeyGTJFMAAVEPSAMK-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.33
Rot. Bonds5

About 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide

2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide (PubChem CID 91829334) has the molecular formula C11H15N3OS2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide.

Molecular Properties

Compound Name2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide
PubChem CID91829334
Molecular FormulaC11H15N3OS2
Molecular Weight269.39 g/mol
Exact Mass269.07
IUPAC Name2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide
SMILESCCSCC(=O)NC(C)c1cn2ccsc2n1
InChIInChI=1S/C11H15N3OS2/c1-3-16-7-10(15)12-8(2)9-6-14-4-5-17-11(14)13-9/h4-6,8H,3,7H2,1-2H3,(H,12,15)
InChIKeyGTJFMAAVEPSAMK-UHFFFAOYSA-N
XLogP2.33
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide?
The IUPAC name of 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide (CID 91829334) is 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide.
What is the SMILES notation for 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide?
The canonical SMILES for 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide is CCSCC(=O)NC(C)c1cn2ccsc2n1.
What is the InChIKey of 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide?
The InChIKey is GTJFMAAVEPSAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS2/c1-3-16-7-10(15)12-8(2)9-6-14-4-5-17-11(14)13-9/h4-6,8H,3,7H2,1-2H3,(H,12,15).
What are the key properties of 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide?
2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide has a molecular weight of 269.39 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfanyl-N-(1-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide is sourced from PubChem (CID 91829334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).