4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine

C9H8F3N3O2S — CID 146624027

IUPAC4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESCOc1ncc(OCC(F)(F)F)c2sc(N)nc12
InChIInChI=1S/C9H8F3N3O2S/c1-16-7-5-6(18-8(13)15-5)4(2-14-7)17-3-9(10,11)12/h2H,3H2,1H3,(H2,13,15)
InChIKeyUWMWQZUJYIVWTA-UHFFFAOYSA-N
MW279.24 g/mol
LogP2.22
Rot. Bonds3

About 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine

4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine (PubChem CID 146624027) has the molecular formula C9H8F3N3O2S and a molecular weight of 279.24 g/mol. Its IUPAC name is 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine
PubChem CID146624027
Molecular FormulaC9H8F3N3O2S
Molecular Weight279.24 g/mol
Exact Mass279.03
IUPAC Name4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESCOc1ncc(OCC(F)(F)F)c2sc(N)nc12
InChIInChI=1S/C9H8F3N3O2S/c1-16-7-5-6(18-8(13)15-5)4(2-14-7)17-3-9(10,11)12/h2H,3H2,1H3,(H2,13,15)
InChIKeyUWMWQZUJYIVWTA-UHFFFAOYSA-N
XLogP2.22
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.24
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The IUPAC name of 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine (CID 146624027) is 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The canonical SMILES for 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine is COc1ncc(OCC(F)(F)F)c2sc(N)nc12.
What is the InChIKey of 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The InChIKey is UWMWQZUJYIVWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3O2S/c1-16-7-5-6(18-8(13)15-5)4(2-14-7)17-3-9(10,11)12/h2H,3H2,1H3,(H2,13,15).
What are the key properties of 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine has a molecular weight of 279.24 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-7-(2,2,2-trifluoroethoxy)-[1,3]thiazolo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 146624027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).