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

C11H11N5OS — CID 137462548

IUPAC4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESCOc1ncc(-c2cnn(C)c2)c2sc(N)nc12
InChIInChI=1S/C11H11N5OS/c1-16-5-6(3-14-16)7-4-13-10(17-2)8-9(7)18-11(12)15-8/h3-5H,1-2H3,(H2,12,15)
InChIKeyYMNLDMYGUBRGJR-UHFFFAOYSA-N
MW261.31 g/mol
LogP1.68
Rot. Bonds2

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

4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine (PubChem CID 137462548) has the molecular formula C11H11N5OS and a molecular weight of 261.31 g/mol. Its IUPAC name is 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine
PubChem CID137462548
Molecular FormulaC11H11N5OS
Molecular Weight261.31 g/mol
Exact Mass261.07
IUPAC Name4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESCOc1ncc(-c2cnn(C)c2)c2sc(N)nc12
InChIInChI=1S/C11H11N5OS/c1-16-5-6(3-14-16)7-4-13-10(17-2)8-9(7)18-11(12)15-8/h3-5H,1-2H3,(H2,12,15)
InChIKeyYMNLDMYGUBRGJR-UHFFFAOYSA-N
XLogP1.68
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.31
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The IUPAC name of 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine (CID 137462548) is 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The canonical SMILES for 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine is COc1ncc(-c2cnn(C)c2)c2sc(N)nc12.
What is the InChIKey of 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The InChIKey is YMNLDMYGUBRGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5OS/c1-16-5-6(3-14-16)7-4-13-10(17-2)8-9(7)18-11(12)15-8/h3-5H,1-2H3,(H2,12,15).
What are the key properties of 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine?
4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine has a molecular weight of 261.31 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-7-(1-methylpyrazol-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 137462548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).