4-methoxy-2-methyl-1,3-thiazole

C5H7NOS — CID 45121779

IUPAC4-methoxy-2-methyl-1,3-thiazole
SMILESCOc1csc(C)n1
InChIInChI=1S/C5H7NOS/c1-4-6-5(7-2)3-8-4/h3H,1-2H3
InChIKeyXFDNQXDLJQTOLE-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.46
Rot. Bonds1

About 4-methoxy-2-methyl-1,3-thiazole

4-methoxy-2-methyl-1,3-thiazole (PubChem CID 45121779) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is 4-methoxy-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-methoxy-2-methyl-1,3-thiazole
PubChem CID45121779
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC Name4-methoxy-2-methyl-1,3-thiazole
SMILESCOc1csc(C)n1
InChIInChI=1S/C5H7NOS/c1-4-6-5(7-2)3-8-4/h3H,1-2H3
InChIKeyXFDNQXDLJQTOLE-UHFFFAOYSA-N
XLogP1.46
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-1,3-thiazole?
The IUPAC name of 4-methoxy-2-methyl-1,3-thiazole (CID 45121779) is 4-methoxy-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-methoxy-2-methyl-1,3-thiazole?
The canonical SMILES for 4-methoxy-2-methyl-1,3-thiazole is COc1csc(C)n1.
What is the InChIKey of 4-methoxy-2-methyl-1,3-thiazole?
The InChIKey is XFDNQXDLJQTOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c1-4-6-5(7-2)3-8-4/h3H,1-2H3.
What are the key properties of 4-methoxy-2-methyl-1,3-thiazole?
4-methoxy-2-methyl-1,3-thiazole has a molecular weight of 129.18 g/mol, XLogP of 1.46, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-1,3-thiazole is sourced from PubChem (CID 45121779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).