8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide

C21H23N5O4 — CID 155437215

About 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide

8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide (PubChem CID 155437215) has the molecular formula C21H23N5O4 and a molecular weight of 409.45 g/mol. Its IUPAC name is 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide.

Molecular Properties

• Compound Name: 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide
• PubChem CID: 155437215
• Molecular Formula: C21H23N5O4
• Molecular Weight: 409.45 g/mol
• Exact Mass: 409.18
• IUPAC Name: 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide
• SMILES: COc1ncccc1NC(=O)c1cn2cc(C34CCC(C)(C3)OC4)nc2c(OC)n1
• InChI: InChI=1S/C21H23N5O4/c1-20-6-7-21(11-20,12-30-20)15-10-26-9-14(24-19(29-3)16(26)25-15)17(27)23-13-5-4-8-22-18(13)28-2/h4-5,8-10H,6-7,11-12H2,1-3H3,(H,23,27)
• InChIKey: LRXBSKQDVZFXHO-UHFFFAOYSA-N
• XLogP: 2.60
• TPSA: 99.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	409.45
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide?

The IUPAC name of 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide (CID 155437215) is 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide.

What is the SMILES notation for 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide?

The canonical SMILES for 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide is COc1ncccc1NC(=O)c1cn2cc(C34CCC(C)(C3)OC4)nc2c(OC)n1.

What is the InChIKey of 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide?

The InChIKey is LRXBSKQDVZFXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O4/c1-20-6-7-21(11-20,12-30-20)15-10-26-9-14(24-19(29-3)16(26)25-15)17(27)23-13-5-4-8-22-18(13)28-2/h4-5,8-10H,6-7,11-12H2,1-3H3,(H,23,27).

What are the key properties of 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide?

8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide has a molecular weight of 409.45 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide is sourced from PubChem (CID 155437215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).