3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide

C14H16N6OS — CID 84590593

IUPAC3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide
SMILESCc1cn2c(CN(C)C(=O)c3nccnc3N)c(C)nc2s1
InChIInChI=1S/C14H16N6OS/c1-8-6-20-10(9(2)18-14(20)22-8)7-19(3)13(21)11-12(15)17-5-4-16-11/h4-6H,7H2,1-3H3,(H2,15,17)
InChIKeyMIZBPVTUBZQJEG-UHFFFAOYSA-N
MW316.39 g/mol
LogP1.66
Rot. Bonds3

About 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide

3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide (PubChem CID 84590593) has the molecular formula C14H16N6OS and a molecular weight of 316.39 g/mol. Its IUPAC name is 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide
PubChem CID84590593
Molecular FormulaC14H16N6OS
Molecular Weight316.39 g/mol
Exact Mass316.11
IUPAC Name3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide
SMILESCc1cn2c(CN(C)C(=O)c3nccnc3N)c(C)nc2s1
InChIInChI=1S/C14H16N6OS/c1-8-6-20-10(9(2)18-14(20)22-8)7-19(3)13(21)11-12(15)17-5-4-16-11/h4-6H,7H2,1-3H3,(H2,15,17)
InChIKeyMIZBPVTUBZQJEG-UHFFFAOYSA-N
XLogP1.66
TPSA89.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.39
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide 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

1,3-dimethylthiazolo[2,3-f]purine-2,4(1H,3H)-dione
CID 913284
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 742946
N-cyclohexyl-6-methyl-imidazo[2,1-b]thiazole-5-carboxamide
CID 126471433
N-(1-ethylpropylideneamino)-6-methyl-imidazo[2,1-b]thiazole-5-carboxamide
CID 876912
N-(isopropylideneamino)-6-methyl-imidazo[2,1-b]thiazole-5-carboxamide
CID 11195710
6-methyl-N-[(Z)-1-methylpropylideneamino]imidazo[2,1-b]thiazole-5-carboxamide
CID 11425224
5-(1H-imidazol-2-yl)-6-(piperidin-1-ylcarbonyl)imidazo[2,1-b][1,3]thiazole
CID 56919250
N-[(2-Isopropyl-1,3-thiazol-4-YL)methyl]-N-methylimidazo[2,1-B][1,3]thiazole-6-carboxamide
CID 70787077
3-Ethyl-7-(3-methylbut-2-enyl)-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]purine-2,6-dione
CID 172439472
3-Ethyl-7-(3-methoxypropyl)-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]purine-2,6-dione
CID 172440454
3-Ethyl-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-7-propan-2-ylpurine-2,6-dione
CID 172453425
3-Ethyl-8-[(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]-7-(4-methylpent-3-enyl)purine-2,6-dione
CID 172466201

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide (CID 84590593) is 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide is Cc1cn2c(CN(C)C(=O)c3nccnc3N)c(C)nc2s1.
What is the InChIKey of 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide?
The InChIKey is MIZBPVTUBZQJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6OS/c1-8-6-20-10(9(2)18-14(20)22-8)7-19(3)13(21)11-12(15)17-5-4-16-11/h4-6H,7H2,1-3H3,(H2,15,17).
What are the key properties of 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide?
3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide has a molecular weight of 316.39 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 84590593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).