5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole

C5H7N3S — CID 154724312

IUPAC5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole
SMILESCC1Cn2nncc2S1
InChIInChI=1S/C5H7N3S/c1-4-3-8-5(9-4)2-6-7-8/h2,4H,3H2,1H3
InChIKeyDITQOMZNHMBQHW-UHFFFAOYSA-N
MW141.20 g/mol
LogP0.77
Rot. Bonds

About 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole

5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole (PubChem CID 154724312) has the molecular formula C5H7N3S and a molecular weight of 141.20 g/mol. Its IUPAC name is 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole.

Molecular Properties

Compound Name5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole
PubChem CID154724312
Molecular FormulaC5H7N3S
Molecular Weight141.20 g/mol
Exact Mass141.04
IUPAC Name5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole
SMILESCC1Cn2nncc2S1
InChIInChI=1S/C5H7N3S/c1-4-3-8-5(9-4)2-6-7-8/h2,4H,3H2,1H3
InChIKeyDITQOMZNHMBQHW-UHFFFAOYSA-N
XLogP0.77
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.20
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole 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 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole?
The IUPAC name of 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole (CID 154724312) is 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole.
What is the SMILES notation for 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole?
The canonical SMILES for 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole is CC1Cn2nncc2S1.
What is the InChIKey of 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole?
The InChIKey is DITQOMZNHMBQHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3S/c1-4-3-8-5(9-4)2-6-7-8/h2,4H,3H2,1H3.
What are the key properties of 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole?
5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole has a molecular weight of 141.20 g/mol, XLogP of 0.77, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5,6-dihydro-[1,3]thiazolo[3,2-c]triazole is sourced from PubChem (CID 154724312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).