4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]

C64H67ClF2N8O6 — CID 160991369

About 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]

4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane] (PubChem CID 160991369) has the molecular formula C64H67ClF2N8O6 and a molecular weight of 1117.74 g/mol. Its IUPAC name is 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane].

Molecular Properties

• Compound Name: 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]
• PubChem CID: 160991369
• Molecular Formula: C64H67ClF2N8O6
• Molecular Weight: 1117.74 g/mol
• Exact Mass: 1116.48
• IUPAC Name: 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]
• SMILES: COc1cccc(-c2nc3cc(F)ccc3c(Cl)c2C)n1.COc1cccc(-c2nc3cc(F)ccc3c(N3CC4(CCOCC4)c4ccc(N5CCOCC5)cc43)c2C)n1.c1cc2c(cc1N1CCOCC1)NCC21CCOCC1
• InChI: InChI=1S/C32H33FN4O3.C16H12ClFN2O.C16H22N2O2/c1-21-30(26-4-3-5-29(34-26)38-2)35-27-18-22(33)6-8-24(27)31(21)37-20-32(10-14-39-15-11-32)25-9-7-23(19-28(25)37)36-12-16-40-17-13-36;1-9-15(17)11-7-6-10(18)8-13(11)20-16(9)12-4-3-5-14(19-12)21-2;1-2-14-15(11-13(1)18-5-9-20-10-6-18)17-12-16(14)3-7-19-8-4-16/h3-9,18-19H,10-17,20H2,1-2H3;3-8H,1-2H3;1-2,11,17H,3-10,12H2
• InChIKey: TURFMZQVQSTSEF-UHFFFAOYSA-N
• XLogP: 12.19
• TPSA: 128.69 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 7
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1117.74
LogP ≤ 5	12.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]?

The IUPAC name of 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane] (CID 160991369) is 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane].

What is the SMILES notation for 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]?

The canonical SMILES for 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane] is COc1cccc(-c2nc3cc(F)ccc3c(Cl)c2C)n1.COc1cccc(-c2nc3cc(F)ccc3c(N3CC4(CCOCC4)c4ccc(N5CCOCC5)cc43)c2C)n1.c1cc2c(cc1N1CCOCC1)NCC21CCOCC1.

What is the InChIKey of 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]?

The InChIKey is TURFMZQVQSTSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H33FN4O3.C16H12ClFN2O.C16H22N2O2/c1-21-30(26-4-3-5-29(34-26)38-2)35-27-18-22(33)6-8-24(27)31(21)37-20-32(10-14-39-15-11-32)25-9-7-23(19-28(25)37)36-12-16-40-17-13-36;1-9-15(17)11-7-6-10(18)8-13(11)20-16(9)12-4-3-5-14(19-12)21-2;1-2-14-15(11-13(1)18-5-9-20-10-6-18)17-12-16(14)3-7-19-8-4-16/h3-9,18-19H,10-17,20H2,1-2H3;3-8H,1-2H3;1-2,11,17H,3-10,12H2.

What are the key properties of 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane]?

4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane] has a molecular weight of 1117.74 g/mol, XLogP of 12.19, 7 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinoline;1-[7-fluoro-2-(6-methoxy-2-pyridinyl)-3-methylquinolin-4-yl]-6-morpholin-4-ylspiro[2H-indole-3,4'-oxane];6-morpholin-4-ylspiro[1,2-dihydroindole-3,4'-oxane] is sourced from PubChem (CID 160991369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).