6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

C5H6N4S — CID 733193

IUPAC6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCc1csc2nc(N)nn12
InChIInChI=1S/C5H6N4S/c1-3-2-10-5-7-4(6)8-9(3)5/h2H,1H3,(H2,6,8)
InChIKeyCQMXVRSRZTVQPU-UHFFFAOYSA-N
MW154.20 g/mol
LogP0.68
Rot. Bonds

About 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (PubChem CID 733193) has the molecular formula C5H6N4S and a molecular weight of 154.20 g/mol. Its IUPAC name is 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.

Molecular Properties

Compound Name6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
PubChem CID733193
Molecular FormulaC5H6N4S
Molecular Weight154.20 g/mol
Exact Mass154.03
IUPAC Name6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCc1csc2nc(N)nn12
InChIInChI=1S/C5H6N4S/c1-3-2-10-5-7-4(6)8-9(3)5/h2H,1H3,(H2,6,8)
InChIKeyCQMXVRSRZTVQPU-UHFFFAOYSA-N
XLogP0.68
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The IUPAC name of 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (CID 733193) is 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.
What is the SMILES notation for 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The canonical SMILES for 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is Cc1csc2nc(N)nn12.
What is the InChIKey of 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The InChIKey is CQMXVRSRZTVQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4S/c1-3-2-10-5-7-4(6)8-9(3)5/h2H,1H3,(H2,6,8).
What are the key properties of 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine has a molecular weight of 154.20 g/mol, XLogP of 0.68, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is sourced from PubChem (CID 733193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).