3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine

C20H20F3N7 — CID 169129471

About 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine

3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine (PubChem CID 169129471) has the molecular formula C20H20F3N7 and a molecular weight of 415.42 g/mol. Its IUPAC name is 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine.

Molecular Properties

• Compound Name: 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine
• PubChem CID: 169129471
• Molecular Formula: C20H20F3N7
• Molecular Weight: 415.42 g/mol
• Exact Mass: 415.17
• IUPAC Name: 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine
• SMILES: Cc1cnc(-c2ccn3c(-c4nc(N)c(F)cc4F)cnc3c2)[nH]1.FC1CCNC1
• InChI: InChI=1S/C16H12F2N6.C4H8FN/c1-8-6-21-16(22-8)9-2-3-24-12(7-20-13(24)4-9)14-10(17)5-11(18)15(19)23-14;5-4-1-2-6-3-4/h2-7H,1H3,(H2,19,23)(H,21,22);4,6H,1-3H2
• InChIKey: ATCHYKOLRKMVTL-UHFFFAOYSA-N
• XLogP: 3.27
• TPSA: 96.92 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	415.42
LogP ≤ 5	3.27
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine?

The IUPAC name of 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine (CID 169129471) is 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine.

What is the SMILES notation for 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine?

The canonical SMILES for 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine is Cc1cnc(-c2ccn3c(-c4nc(N)c(F)cc4F)cnc3c2)[nH]1.FC1CCNC1.

What is the InChIKey of 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine?

The InChIKey is ATCHYKOLRKMVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N6.C4H8FN/c1-8-6-21-16(22-8)9-2-3-24-12(7-20-13(24)4-9)14-10(17)5-11(18)15(19)23-14;5-4-1-2-6-3-4/h2-7H,1H3,(H2,19,23)(H,21,22);4,6H,1-3H2.

What are the key properties of 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine?

3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine has a molecular weight of 415.42 g/mol, XLogP of 3.27, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-difluoro-6-[7-(5-methyl-1H-imidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-fluoropyrrolidine is sourced from PubChem (CID 169129471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).