6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine

C18H22N8 — CID 126724656

IUPAC6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine
SMILESCC(C)(C)c1cn2nc(CC(C)(C)c3cn4cncnc4n3)cnc2n1
InChIInChI=1S/C18H22N8/c1-17(2,3)13-9-26-16(22-13)20-7-12(24-26)6-18(4,5)14-8-25-11-19-10-21-15(25)23-14/h7-11H,6H2,1-5H3
InChIKeyKAJMWVPCWFUQJE-UHFFFAOYSA-N
MW350.43 g/mol
LogP2.38
Rot. Bonds3

About 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine

6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine (PubChem CID 126724656) has the molecular formula C18H22N8 and a molecular weight of 350.43 g/mol. Its IUPAC name is 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine.

Molecular Properties

Compound Name6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine
PubChem CID126724656
Molecular FormulaC18H22N8
Molecular Weight350.43 g/mol
Exact Mass350.20
IUPAC Name6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine
SMILESCC(C)(C)c1cn2nc(CC(C)(C)c3cn4cncnc4n3)cnc2n1
InChIInChI=1S/C18H22N8/c1-17(2,3)13-9-26-16(22-13)20-7-12(24-26)6-18(4,5)14-8-25-11-19-10-21-15(25)23-14/h7-11H,6H2,1-5H3
InChIKeyKAJMWVPCWFUQJE-UHFFFAOYSA-N
XLogP2.38
TPSA86.16 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine with MolForge

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Related Compounds

2-tert-butylimidazo[1,2-a]pyrimidine-6-carbaldehyde
CID 83832182
2-tert-butylimidazo[1,2-a]pyrimidine;2,2-dimethylpropane
CID 158552648
1-(2-tert-butylimidazo[1,2-a]pyrimidin-6-yl)ethanamine
CID 83836823
6-tert-butyl-3-(2-imidazo[2,1-f][1,2,4]triazin-6-yl-2-methylpropyl)imidazo[1,2-c]triazine
CID 130267933
5-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 58270253
2-(2-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanamine
CID 84786911
2,7-bis(3-methylpentan-3-yl)imidazo[1,2-a]pyrimidine
CID 129074127
3-tert-butylimidazo[1,2-b][1,2,4]triazine
CID 22329563
2-tert-butylimidazo[1,5-a]pyrimidine
CID 138656525
6-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 178058157
6,8-ditert-butyl-[1,2,4]triazolo[4,3-a]pyrazine
CID 167341893
N-(2-methoxyethyl)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-2-amine
CID 139606318

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine?
The IUPAC name of 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine (CID 126724656) is 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine.
What is the SMILES notation for 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine?
The canonical SMILES for 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine is CC(C)(C)c1cn2nc(CC(C)(C)c3cn4cncnc4n3)cnc2n1.
What is the InChIKey of 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine?
The InChIKey is KAJMWVPCWFUQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N8/c1-17(2,3)13-9-26-16(22-13)20-7-12(24-26)6-18(4,5)14-8-25-11-19-10-21-15(25)23-14/h7-11H,6H2,1-5H3.
What are the key properties of 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine?
6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine has a molecular weight of 350.43 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2-(2-imidazo[1,2-a][1,3,5]triazin-7-yl-2-methylpropyl)imidazo[1,2-b][1,2,4]triazine is sourced from PubChem (CID 126724656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).