N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

C12H14N6S — CID 108772183

IUPACN-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCc1cc(C)nc(Nc2nc3sc(C)c(C)n3n2)n1
InChIInChI=1S/C12H14N6S/c1-6-5-7(2)14-10(13-6)15-11-16-12-18(17-11)8(3)9(4)19-12/h5H,1-4H3,(H,13,14,15,17)
InChIKeyHIYXSOYVUIHDJZ-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.56
Rot. Bonds2

About N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (PubChem CID 108772183) has the molecular formula C12H14N6S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
PubChem CID108772183
Molecular FormulaC12H14N6S
Molecular Weight274.35 g/mol
Exact Mass274.10
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCc1cc(C)nc(Nc2nc3sc(C)c(C)n3n2)n1
InChIInChI=1S/C12H14N6S/c1-6-5-7(2)14-10(13-6)15-11-16-12-18(17-11)8(3)9(4)19-12/h5H,1-4H3,(H,13,14,15,17)
InChIKeyHIYXSOYVUIHDJZ-UHFFFAOYSA-N
XLogP2.56
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-chloro-2-ethylpyrimidin-4-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108772209
N-(4,6-dimethylpyrimidin-2-yl)-4,6-dimethylpyrimidin-2-amine
CID 155453170
N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-4-propan-2-ylbenzamide
CID 108727684
phenyl N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)carbamate
CID 108727693
3-(4-chlorophenyl)-N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide
CID 108727655
N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-2-(4-fluorophenyl)acetamide
CID 108751609
2-(4-chloro-3,5-dimethylphenoxy)-N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)acetamide
CID 108751712
4-(3,4-dimethylphenyl)-N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-4-oxobutanamide
CID 108727737
prop-2-enyl N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)carbamate
CID 108727687
N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-2-oxochromene-3-carboxamide
CID 108727609
2-[(4,6-dimethylpyrimidin-2-yl)amino]-6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one
CID 135882047
N-(5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108751705

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (CID 108772183) is N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is Cc1cc(C)nc(Nc2nc3sc(C)c(C)n3n2)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The InChIKey is HIYXSOYVUIHDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6S/c1-6-5-7(2)14-10(13-6)15-11-16-12-18(17-11)8(3)9(4)19-12/h5H,1-4H3,(H,13,14,15,17).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine has a molecular weight of 274.35 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)-5,6-dimethyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is sourced from PubChem (CID 108772183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).