4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole

C8H10F3NOS — CID 107511939

IUPAC4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole
SMILESCOCc1csc(CCC(F)(F)F)n1
InChIInChI=1S/C8H10F3NOS/c1-13-4-6-5-14-7(12-6)2-3-8(9,10)11/h5H,2-4H2,1H3
InChIKeyRSGITWXMPRNCCY-UHFFFAOYSA-N
MW225.23 g/mol
LogP2.78
Rot. Bonds4

About 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole

4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole (PubChem CID 107511939) has the molecular formula C8H10F3NOS and a molecular weight of 225.23 g/mol. Its IUPAC name is 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole
PubChem CID107511939
Molecular FormulaC8H10F3NOS
Molecular Weight225.23 g/mol
Exact Mass225.04
IUPAC Name4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole
SMILESCOCc1csc(CCC(F)(F)F)n1
InChIInChI=1S/C8H10F3NOS/c1-13-4-6-5-14-7(12-6)2-3-8(9,10)11/h5H,2-4H2,1H3
InChIKeyRSGITWXMPRNCCY-UHFFFAOYSA-N
XLogP2.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.23
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole?
The IUPAC name of 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole (CID 107511939) is 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole.
What is the SMILES notation for 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole?
The canonical SMILES for 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole is COCc1csc(CCC(F)(F)F)n1.
What is the InChIKey of 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole?
The InChIKey is RSGITWXMPRNCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3NOS/c1-13-4-6-5-14-7(12-6)2-3-8(9,10)11/h5H,2-4H2,1H3.
What are the key properties of 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole?
4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole has a molecular weight of 225.23 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-2-(3,3,3-trifluoropropyl)-1,3-thiazole is sourced from PubChem (CID 107511939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).