[1,3]thiazolo[4,5-b]pyridine-2,5-diamine

C6H6N4S — CID 2337481

IUPAC[1,3]thiazolo[4,5-b]pyridine-2,5-diamine
SMILESNc1ccc2sc(N)nc2n1
InChIInChI=1S/C6H6N4S/c7-4-2-1-3-5(9-4)10-6(8)11-3/h1-2H,(H4,7,8,9,10)
InChIKeyOUQVIBJBPCRCAT-UHFFFAOYSA-N
MW166.21 g/mol
LogP0.86
Rot. Bonds

About [1,3]thiazolo[4,5-b]pyridine-2,5-diamine

[1,3]thiazolo[4,5-b]pyridine-2,5-diamine (PubChem CID 2337481) has the molecular formula C6H6N4S and a molecular weight of 166.21 g/mol. Its IUPAC name is [1,3]thiazolo[4,5-b]pyridine-2,5-diamine.

Molecular Properties

Compound Name[1,3]thiazolo[4,5-b]pyridine-2,5-diamine
PubChem CID2337481
Molecular FormulaC6H6N4S
Molecular Weight166.21 g/mol
Exact Mass166.03
IUPAC Name[1,3]thiazolo[4,5-b]pyridine-2,5-diamine
SMILESNc1ccc2sc(N)nc2n1
InChIInChI=1S/C6H6N4S/c7-4-2-1-3-5(9-4)10-6(8)11-3/h1-2H,(H4,7,8,9,10)
InChIKeyOUQVIBJBPCRCAT-UHFFFAOYSA-N
XLogP0.86
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1,3]thiazolo[4,5-b]pyridine-2,5-diamine?
The IUPAC name of [1,3]thiazolo[4,5-b]pyridine-2,5-diamine (CID 2337481) is [1,3]thiazolo[4,5-b]pyridine-2,5-diamine.
What is the SMILES notation for [1,3]thiazolo[4,5-b]pyridine-2,5-diamine?
The canonical SMILES for [1,3]thiazolo[4,5-b]pyridine-2,5-diamine is Nc1ccc2sc(N)nc2n1.
What is the InChIKey of [1,3]thiazolo[4,5-b]pyridine-2,5-diamine?
The InChIKey is OUQVIBJBPCRCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4S/c7-4-2-1-3-5(9-4)10-6(8)11-3/h1-2H,(H4,7,8,9,10).
What are the key properties of [1,3]thiazolo[4,5-b]pyridine-2,5-diamine?
[1,3]thiazolo[4,5-b]pyridine-2,5-diamine has a molecular weight of 166.21 g/mol, XLogP of 0.86, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,3]thiazolo[4,5-b]pyridine-2,5-diamine is sourced from PubChem (CID 2337481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).