5-(2-ethoxyethyl)-1,3-thiazole

C7H11NOS — CID 67275426

IUPAC5-(2-ethoxyethyl)-1,3-thiazole
SMILESCCOCCc1cncs1
InChIInChI=1S/C7H11NOS/c1-2-9-4-3-7-5-8-6-10-7/h5-6H,2-4H2,1H3
InChIKeyXURIOJRPYNGTQM-UHFFFAOYSA-N
MW157.24 g/mol
LogP1.72
Rot. Bonds4

About 5-(2-ethoxyethyl)-1,3-thiazole

5-(2-ethoxyethyl)-1,3-thiazole (PubChem CID 67275426) has the molecular formula C7H11NOS and a molecular weight of 157.24 g/mol. Its IUPAC name is 5-(2-ethoxyethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-(2-ethoxyethyl)-1,3-thiazole
PubChem CID67275426
Molecular FormulaC7H11NOS
Molecular Weight157.24 g/mol
Exact Mass157.06
IUPAC Name5-(2-ethoxyethyl)-1,3-thiazole
SMILESCCOCCc1cncs1
InChIInChI=1S/C7H11NOS/c1-2-9-4-3-7-5-8-6-10-7/h5-6H,2-4H2,1H3
InChIKeyXURIOJRPYNGTQM-UHFFFAOYSA-N
XLogP1.72
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-Ethylthiazole
CID 519456
2-(1,3-Thiazol-5-yl)ethan-1-ol
CID 11389596
Methyl 2-(1,3-thiazol-5-yl)acetate
CID 28811855
2-(2-Methyl-thiazol-5-yl)-ethanol
CID 529638
Ethyl 2-(2-bromo-1,3-thiazol-5-yl)acetate
CID 54136618
2-(2-Bromo-1,3-thiazol-5-yl)ethan-1-ol
CID 68557594
5-Ethyl-2-methoxythiazole
CID 12743062
2-(2-Chloro-1,3-thiazol-5-yl)ethan-1-ol
CID 71721295
5-(2-Methoxyethyl)-1,3-thiazol-2-amine hydrochloride
CID 132354260
5-(2,2-Dimethoxyethyl)-2-methyl-1,3-thiazole
CID 138987761
Ethyl 2-(thiazol-5-yl)acetate
CID 20358489
5-Ethyl-2-(methylthio)thiazole
CID 20577908

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyethyl)-1,3-thiazole?
The IUPAC name of 5-(2-ethoxyethyl)-1,3-thiazole (CID 67275426) is 5-(2-ethoxyethyl)-1,3-thiazole.
What is the SMILES notation for 5-(2-ethoxyethyl)-1,3-thiazole?
The canonical SMILES for 5-(2-ethoxyethyl)-1,3-thiazole is CCOCCc1cncs1.
What is the InChIKey of 5-(2-ethoxyethyl)-1,3-thiazole?
The InChIKey is XURIOJRPYNGTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-2-9-4-3-7-5-8-6-10-7/h5-6H,2-4H2,1H3.
What are the key properties of 5-(2-ethoxyethyl)-1,3-thiazole?
5-(2-ethoxyethyl)-1,3-thiazole has a molecular weight of 157.24 g/mol, XLogP of 1.72, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyethyl)-1,3-thiazole is sourced from PubChem (CID 67275426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).