N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide

C23H20F3N3O2 — CID 3533299

About N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide

N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 3533299) has the molecular formula C23H20F3N3O2 and a molecular weight of 427.43 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

• Compound Name: N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide
• PubChem CID: 3533299
• Molecular Formula: C23H20F3N3O2
• Molecular Weight: 427.43 g/mol
• Exact Mass: 427.15
• IUPAC Name: N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide
• SMILES: Cc1cccn2c(C(CC(=O)NCc3ccco3)c3cccc(C(F)(F)F)c3)cnc12
• InChI: InChI=1S/C23H20F3N3O2/c1-15-5-3-9-29-20(14-28-22(15)29)19(12-21(30)27-13-18-8-4-10-31-18)16-6-2-7-17(11-16)23(24,25)26/h2-11,14,19H,12-13H2,1H3,(H,27,30)
• InChIKey: DBZHULPXGOOBLL-UHFFFAOYSA-N
• XLogP: 5.09
• TPSA: 59.54 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	427.43
LogP ≤ 5	5.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide?

The IUPAC name of N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide (CID 3533299) is N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide.

What is the SMILES notation for N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide?

The canonical SMILES for N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide is Cc1cccn2c(C(CC(=O)NCc3ccco3)c3cccc(C(F)(F)F)c3)cnc12.

What is the InChIKey of N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide?

The InChIKey is DBZHULPXGOOBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F3N3O2/c1-15-5-3-9-29-20(14-28-22(15)29)19(12-21(30)27-13-18-8-4-10-31-18)16-6-2-7-17(11-16)23(24,25)26/h2-11,14,19H,12-13H2,1H3,(H,27,30).

What are the key properties of N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide?

N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 427.43 g/mol, XLogP of 5.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(furan-2-ylmethyl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 3533299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).