7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one

C24H18F3N5O2 — CID 155343700

About 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one

7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one (PubChem CID 155343700) has the molecular formula C24H18F3N5O2 and a molecular weight of 465.44 g/mol. Its IUPAC name is 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one.

Molecular Properties

• Compound Name: 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one
• PubChem CID: 155343700
• Molecular Formula: C24H18F3N5O2
• Molecular Weight: 465.44 g/mol
• Exact Mass: 465.14
• IUPAC Name: 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one
• SMILES: CCOc1ccc2cc(-c3ccc4nn(C)cc4c3)c(=O)n(-c3ccc(C(F)(F)F)nc3)c2n1
• InChI: InChI=1S/C24H18F3N5O2/c1-3-34-21-9-5-15-11-18(14-4-7-19-16(10-14)13-31(2)30-19)23(33)32(22(15)29-21)17-6-8-20(28-12-17)24(25,26)27/h4-13H,3H2,1-2H3
• InChIKey: NMNFDOFBJCZABV-UHFFFAOYSA-N
• XLogP: 4.75
• TPSA: 74.83 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	465.44
LogP ≤ 5	4.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one?

The IUPAC name of 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one (CID 155343700) is 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one.

What is the SMILES notation for 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one?

The canonical SMILES for 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one is CCOc1ccc2cc(-c3ccc4nn(C)cc4c3)c(=O)n(-c3ccc(C(F)(F)F)nc3)c2n1.

What is the InChIKey of 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one?

The InChIKey is NMNFDOFBJCZABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F3N5O2/c1-3-34-21-9-5-15-11-18(14-4-7-19-16(10-14)13-31(2)30-19)23(33)32(22(15)29-21)17-6-8-20(28-12-17)24(25,26)27/h4-13H,3H2,1-2H3.

What are the key properties of 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one?

7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one has a molecular weight of 465.44 g/mol, XLogP of 4.75, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one is sourced from PubChem (CID 155343700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).