8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C28H26F5N5O2 — CID 86724783

About 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 86724783) has the molecular formula C28H26F5N5O2 and a molecular weight of 559.54 g/mol. Its IUPAC name is 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 86724783
• Molecular Formula: C28H26F5N5O2
• Molecular Weight: 559.54 g/mol
• Exact Mass: 559.20
• IUPAC Name: 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
• SMILES: CCC1CC(NC(=O)c2c(C)nc3c(OCc4c(F)cccc4F)cc(C)cn23)c2nc(C(F)(F)F)ccc2N1
• InChI: InChI=1S/C28H26F5N5O2/c1-4-16-11-21(24-20(35-16)8-9-23(37-24)28(31,32)33)36-27(39)25-15(3)34-26-22(10-14(2)12-38(25)26)40-13-17-18(29)6-5-7-19(17)30/h5-10,12,16,21,35H,4,11,13H2,1-3H3,(H,36,39)
• InChIKey: JEJWNSQPIYRHNU-UHFFFAOYSA-N
• XLogP: 6.29
• TPSA: 80.55 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	559.54
LogP ≤ 5	6.29
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 86724783) is 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is CCC1CC(NC(=O)c2c(C)nc3c(OCc4c(F)cccc4F)cc(C)cn23)c2nc(C(F)(F)F)ccc2N1.

What is the InChIKey of 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is JEJWNSQPIYRHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26F5N5O2/c1-4-16-11-21(24-20(35-16)8-9-23(37-24)28(31,32)33)36-27(39)25-15(3)34-26-22(10-14(2)12-38(25)26)40-13-17-18(29)6-5-7-19(17)30/h5-10,12,16,21,35H,4,11,13H2,1-3H3,(H,36,39).

What are the key properties of 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?

8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 559.54 g/mol, XLogP of 6.29, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[(2,6-difluorophenyl)methoxy]-N-[2-ethyl-6-(trifluoromethyl)-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 86724783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).