5-ethoxy-1,3-thiazole

C5H7NOS — CID 568152

IUPAC5-ethoxy-1,3-thiazole
SMILESCCOc1cncs1
InChIInChI=1S/C5H7NOS/c1-2-7-5-3-6-4-8-5/h3-4H,2H2,1H3
InChIKeyCAYSHAOATVWHSR-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.54
Rot. Bonds2

About 5-ethoxy-1,3-thiazole

5-ethoxy-1,3-thiazole (PubChem CID 568152) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is 5-ethoxy-1,3-thiazole.

Molecular Properties

Compound Name5-ethoxy-1,3-thiazole
PubChem CID568152
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC Name5-ethoxy-1,3-thiazole
SMILESCCOc1cncs1
InChIInChI=1S/C5H7NOS/c1-2-7-5-3-6-4-8-5/h3-4H,2H2,1H3
InChIKeyCAYSHAOATVWHSR-UHFFFAOYSA-N
XLogP1.54
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 118164811
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CID 118363937
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CID 152655927
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CID 154460414
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CID 156409669
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CID 166087800
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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-1,3-thiazole?
The IUPAC name of 5-ethoxy-1,3-thiazole (CID 568152) is 5-ethoxy-1,3-thiazole.
What is the SMILES notation for 5-ethoxy-1,3-thiazole?
The canonical SMILES for 5-ethoxy-1,3-thiazole is CCOc1cncs1.
What is the InChIKey of 5-ethoxy-1,3-thiazole?
The InChIKey is CAYSHAOATVWHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c1-2-7-5-3-6-4-8-5/h3-4H,2H2,1H3.
What are the key properties of 5-ethoxy-1,3-thiazole?
5-ethoxy-1,3-thiazole has a molecular weight of 129.18 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-1,3-thiazole is sourced from PubChem (CID 568152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).