3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C27H20FN3O2 — CID 122284328

About 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 122284328) has the molecular formula C27H20FN3O2 and a molecular weight of 437.47 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

• Compound Name: 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
• PubChem CID: 122284328
• Molecular Formula: C27H20FN3O2
• Molecular Weight: 437.47 g/mol
• Exact Mass: 437.15
• IUPAC Name: 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
• SMILES: Cc1cccn2cc(-c3cccc(NC(=O)c4cccc(Oc5ccc(F)cc5)c4)c3)nc12
• InChI: InChI=1S/C27H20FN3O2/c1-18-5-4-14-31-17-25(30-26(18)31)19-6-2-8-22(15-19)29-27(32)20-7-3-9-24(16-20)33-23-12-10-21(28)11-13-23/h2-17H,1H3,(H,29,32)
• InChIKey: TVDDVLJYPUJOIL-UHFFFAOYSA-N
• XLogP: 6.49
• TPSA: 55.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	437.47
LogP ≤ 5	6.49
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?

The IUPAC name of 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 122284328) is 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

What is the SMILES notation for 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?

The canonical SMILES for 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is Cc1cccn2cc(-c3cccc(NC(=O)c4cccc(Oc5ccc(F)cc5)c4)c3)nc12.

What is the InChIKey of 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?

The InChIKey is TVDDVLJYPUJOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20FN3O2/c1-18-5-4-14-31-17-25(30-26(18)31)19-6-2-8-22(15-19)29-27(32)20-7-3-9-24(16-20)33-23-12-10-21(28)11-13-23/h2-17H,1H3,(H,29,32).

What are the key properties of 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?

3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 437.47 g/mol, XLogP of 6.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(4-fluorophenoxy)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 122284328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).