5-(methoxymethyl)-1,3-thiazole

C5H7NOS — CID 23080896

IUPAC5-(methoxymethyl)-1,3-thiazole
SMILESCOCc1cncs1
InChIInChI=1S/C5H7NOS/c1-7-3-5-2-6-4-8-5/h2,4H,3H2,1H3
InChIKeyCWTKQAXSTULXGB-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.29
Rot. Bonds2

About 5-(methoxymethyl)-1,3-thiazole

5-(methoxymethyl)-1,3-thiazole (PubChem CID 23080896) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is 5-(methoxymethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-(methoxymethyl)-1,3-thiazole
PubChem CID23080896
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC Name5-(methoxymethyl)-1,3-thiazole
SMILESCOCc1cncs1
InChIInChI=1S/C5H7NOS/c1-7-3-5-2-6-4-8-5/h2,4H,3H2,1H3
InChIKeyCWTKQAXSTULXGB-UHFFFAOYSA-N
XLogP1.29
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 ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-1,3-thiazole?
The IUPAC name of 5-(methoxymethyl)-1,3-thiazole (CID 23080896) is 5-(methoxymethyl)-1,3-thiazole.
What is the SMILES notation for 5-(methoxymethyl)-1,3-thiazole?
The canonical SMILES for 5-(methoxymethyl)-1,3-thiazole is COCc1cncs1.
What is the InChIKey of 5-(methoxymethyl)-1,3-thiazole?
The InChIKey is CWTKQAXSTULXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c1-7-3-5-2-6-4-8-5/h2,4H,3H2,1H3.
What are the key properties of 5-(methoxymethyl)-1,3-thiazole?
5-(methoxymethyl)-1,3-thiazole has a molecular weight of 129.18 g/mol, XLogP of 1.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-1,3-thiazole is sourced from PubChem (CID 23080896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).