1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine

C25H24FN3O3 — CID 146271183

About 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine

1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine (PubChem CID 146271183) has the molecular formula C25H24FN3O3 and a molecular weight of 433.48 g/mol. Its IUPAC name is 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine.

Molecular Properties

• Compound Name: 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine
• PubChem CID: 146271183
• Molecular Formula: C25H24FN3O3
• Molecular Weight: 433.48 g/mol
• Exact Mass: 433.18
• IUPAC Name: 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine
• SMILES: Cc1cc2c(F)c(Oc3ccnc4cc(OCCC5(N)CC5)c5c(c34)CCO5)ccc2[nH]1
• InChI: InChI=1S/C25H24FN3O3/c1-14-12-16-17(29-14)2-3-20(23(16)26)32-19-4-9-28-18-13-21(30-11-8-25(27)6-7-25)24-15(22(18)19)5-10-31-24/h2-4,9,12-13,29H,5-8,10-11,27H2,1H3
• InChIKey: YESUEYJXJNKMEZ-UHFFFAOYSA-N
• XLogP: 5.15
• TPSA: 82.39 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	433.48
LogP ≤ 5	5.15
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine?

The IUPAC name of 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine (CID 146271183) is 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine.

What is the SMILES notation for 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine?

The canonical SMILES for 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine is Cc1cc2c(F)c(Oc3ccnc4cc(OCCC5(N)CC5)c5c(c34)CCO5)ccc2[nH]1.

What is the InChIKey of 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine?

The InChIKey is YESUEYJXJNKMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN3O3/c1-14-12-16-17(29-14)2-3-20(23(16)26)32-19-4-9-28-18-13-21(30-11-8-25(27)6-7-25)24-15(22(18)19)5-10-31-24/h2-4,9,12-13,29H,5-8,10-11,27H2,1H3.

What are the key properties of 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine?

1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine has a molecular weight of 433.48 g/mol, XLogP of 5.15, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[[9-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-1,2-dihydrofuro[3,2-f]quinolin-4-yl]oxy]ethyl]cyclopropan-1-amine is sourced from PubChem (CID 146271183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).