8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid

C21H24F3N5O4 — CID 155869278

About 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid

8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid (PubChem CID 155869278) has the molecular formula C21H24F3N5O4 and a molecular weight of 467.45 g/mol. Its IUPAC name is 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid.

Molecular Properties

• Compound Name: 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid
• PubChem CID: 155869278
• Molecular Formula: C21H24F3N5O4
• Molecular Weight: 467.45 g/mol
• Exact Mass: 467.18
• IUPAC Name: 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid
• SMILES: CC1CC1C(=O)N1CCn2cc(C(=O)NCc3ccccn3)nc2C1C.O=C(O)C(F)(F)F
• InChI: InChI=1S/C19H23N5O2.C2HF3O2/c1-12-9-15(12)19(26)24-8-7-23-11-16(22-17(23)13(24)2)18(25)21-10-14-5-3-4-6-20-14;3-2(4,5)1(6)7/h3-6,11-13,15H,7-10H2,1-2H3,(H,21,25);(H,6,7)
• InChIKey: LIISFYUIIAOQKG-UHFFFAOYSA-N
• XLogP: 2.40
• TPSA: 117.42 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	467.45
LogP ≤ 5	2.40
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid?

The IUPAC name of 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid (CID 155869278) is 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid.

What is the SMILES notation for 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid?

The canonical SMILES for 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid is CC1CC1C(=O)N1CCn2cc(C(=O)NCc3ccccn3)nc2C1C.O=C(O)C(F)(F)F.

What is the InChIKey of 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid?

The InChIKey is LIISFYUIIAOQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2.C2HF3O2/c1-12-9-15(12)19(26)24-8-7-23-11-16(22-17(23)13(24)2)18(25)21-10-14-5-3-4-6-20-14;3-2(4,5)1(6)7/h3-6,11-13,15H,7-10H2,1-2H3,(H,21,25);(H,6,7).

What are the key properties of 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid?

8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid has a molecular weight of 467.45 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-methyl-7-(2-methylcyclopropanecarbonyl)-N-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 155869278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).