2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine

C36H32F2N12O — CID 126557475

About 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine

2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 126557475) has the molecular formula C36H32F2N12O and a molecular weight of 686.73 g/mol. Its IUPAC name is 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

• Compound Name: 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine
• PubChem CID: 126557475
• Molecular Formula: C36H32F2N12O
• Molecular Weight: 686.73 g/mol
• Exact Mass: 686.28
• IUPAC Name: 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine
• SMILES: COc1cc(F)cn2c(C)c(C3C[C@@H]3c3nc4c(C)ncc(-c5ncc(C)n6nc(C7CC7c7nc8cc(C)c(F)cn8c7C)nc56)n4n3)nc12
• InChI: InChI=1S/C36H32F2N12O/c1-15-7-28-41-29(18(4)47(28)14-25(15)38)21-9-23(21)33-44-36-31(40-11-16(2)49(36)45-33)26-12-39-17(3)34-43-32(46-50(26)34)24-10-22(24)30-19(5)48-13-20(37)8-27(51-6)35(48)42-30/h7-8,11-14,21-24H,9-10H2,1-6H3/t21?,22?,23?,24-/m0/s1
• InChIKey: LKEBOIPAFWMIQY-GVWQBGCGSA-N
• XLogP: 5.90
• TPSA: 129.99 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 6
• Heavy Atoms: 51
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	686.73
LogP ≤ 5	5.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine?

The IUPAC name of 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine (CID 126557475) is 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine.

What is the SMILES notation for 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine?

The canonical SMILES for 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine is COc1cc(F)cn2c(C)c(C3C[C@@H]3c3nc4c(C)ncc(-c5ncc(C)n6nc(C7CC7c7nc8cc(C)c(F)cn8c7C)nc56)n4n3)nc12.

What is the InChIKey of 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine?

The InChIKey is LKEBOIPAFWMIQY-GVWQBGCGSA-N. The full InChI is InChI=1S/C36H32F2N12O/c1-15-7-28-41-29(18(4)47(28)14-25(15)38)21-9-23(21)33-44-36-31(40-11-16(2)49(36)45-33)26-12-39-17(3)34-43-32(46-50(26)34)24-10-22(24)30-19(5)48-13-20(37)8-27(51-6)35(48)42-30/h7-8,11-14,21-24H,9-10H2,1-6H3/t21?,22?,23?,24-/m0/s1.

What are the key properties of 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine?

2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 686.73 g/mol, XLogP of 5.90, 6 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(6-fluoro-3,7-dimethylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-[2-[(1S)-2-(6-fluoro-8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)cyclopropyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 126557475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).