7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine

C17H22N6 — CID 154754041

About 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine

7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 154754041) has the molecular formula C17H22N6 and a molecular weight of 310.41 g/mol. Its IUPAC name is 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

• Compound Name: 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
• PubChem CID: 154754041
• Molecular Formula: C17H22N6
• Molecular Weight: 310.41 g/mol
• Exact Mass: 310.19
• IUPAC Name: 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
• SMILES: CC(C)c1nnc2n1CCN(Cc1cccc3nccn13)C2C
• InChI: InChI=1S/C17H22N6/c1-12(2)16-19-20-17-13(3)21(9-10-23(16)17)11-14-5-4-6-15-18-7-8-22(14)15/h4-8,12-13H,9-11H2,1-3H3
• InChIKey: QENHHWDNJSLNGA-UHFFFAOYSA-N
• XLogP: 2.63
• TPSA: 51.25 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	310.41
LogP ≤ 5	2.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?

The IUPAC name of 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine (CID 154754041) is 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine.

What is the SMILES notation for 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?

The canonical SMILES for 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine is CC(C)c1nnc2n1CCN(Cc1cccc3nccn13)C2C.

What is the InChIKey of 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?

The InChIKey is QENHHWDNJSLNGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6/c1-12(2)16-19-20-17-13(3)21(9-10-23(16)17)11-14-5-4-6-15-18-7-8-22(14)15/h4-8,12-13H,9-11H2,1-3H3.

What are the key properties of 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?

7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 310.41 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(imidazo[1,2-a]pyridin-5-ylmethyl)-8-methyl-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 154754041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).