[1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone

C113H136ClF3N12O16S — CID 159633078

About [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone

[1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone (PubChem CID 159633078) has the molecular formula C113H136ClF3N12O16S and a molecular weight of 2042.91 g/mol. Its IUPAC name is [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone.

Molecular Properties

• Compound Name: [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone
• PubChem CID: 159633078
• Molecular Formula: C113H136ClF3N12O16S
• Molecular Weight: 2042.91 g/mol
• Exact Mass: 2040.96
• IUPAC Name: [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone
• SMILES: COc1cc2c(cc1OC(C)C)-n1c(-c3cc(Cl)ccc3F)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3ccc(F)c(F)c3)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3sc(C)cc3C)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(C3=CCCC3(C)C)nc(C(=O)N3CCOCC3(C)C)c1CC2
• InChI: InChI=1S/C29H39N3O4.C28H31ClFN3O4.C28H31F2N3O4.C28H35N3O4S/c1-18(2)36-24-16-22-19(15-23(24)34-7)10-11-21-25(27(33)31-13-14-35-17-29(31,5)6)30-26(32(21)22)20-9-8-12-28(20,3)4;1-16(2)37-24-14-22-17(12-23(24)35-5)6-9-21-25(27(34)32-10-11-36-15-28(32,3)4)31-26(33(21)22)19-13-18(29)7-8-20(19)30;1-16(2)37-24-14-22-17(13-23(24)35-5)7-9-21-25(27(34)32-10-11-36-15-28(32,3)4)31-26(33(21)22)18-6-8-19(29)20(30)12-18;1-16(2)35-23-14-21-19(13-22(23)33-7)8-9-20-24(27(32)30-10-11-34-15-28(30,5)6)29-26(31(20)21)25-17(3)12-18(4)36-25/h9,15-16,18H,8,10-14,17H2,1-7H3;7-8,12-14,16H,6,9-11,15H2,1-5H3;6,8,12-14,16H,7,9-11,15H2,1-5H3;12-14,16H,8-11,15H2,1-7H3
• InChIKey: MPJNGCUCNCQBJN-UHFFFAOYSA-N
• XLogP: 21.02
• TPSA: 263.28 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2042.91
LogP ≤ 5	21.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The IUPAC name of [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone (CID 159633078) is [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone.

What is the SMILES notation for [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The canonical SMILES for [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone is COc1cc2c(cc1OC(C)C)-n1c(-c3cc(Cl)ccc3F)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3ccc(F)c(F)c3)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(-c3sc(C)cc3C)nc(C(=O)N3CCOCC3(C)C)c1CC2.COc1cc2c(cc1OC(C)C)-n1c(C3=CCCC3(C)C)nc(C(=O)N3CCOCC3(C)C)c1CC2.

What is the InChIKey of [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The InChIKey is MPJNGCUCNCQBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H39N3O4.C28H31ClFN3O4.C28H31F2N3O4.C28H35N3O4S/c1-18(2)36-24-16-22-19(15-23(24)34-7)10-11-21-25(27(33)31-13-14-35-17-29(31,5)6)30-26(32(21)22)20-9-8-12-28(20,3)4;1-16(2)37-24-14-22-17(12-23(24)35-5)6-9-21-25(27(34)32-10-11-36-15-28(32,3)4)31-26(33(21)22)19-13-18(29)7-8-20(19)30;1-16(2)37-24-14-22-17(13-23(24)35-5)7-9-21-25(27(34)32-10-11-36-15-28(32,3)4)31-26(33(21)22)18-6-8-19(29)20(30)12-18;1-16(2)35-23-14-21-19(13-22(23)33-7)8-9-20-24(27(32)30-10-11-34-15-28(30,5)6)29-26(31(20)21)25-17(3)12-18(4)36-25/h9,15-16,18H,8,10-14,17H2,1-7H3;7-8,12-14,16H,6,9-11,15H2,1-5H3;6,8,12-14,16H,7,9-11,15H2,1-5H3;12-14,16H,8-11,15H2,1-7H3.

What are the key properties of [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

[1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone has a molecular weight of 2042.91 g/mol, XLogP of 21.02, 20 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(5-chloro-2-fluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(3,4-difluorophenyl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;[1-(5,5-dimethylcyclopenten-1-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]-(3,3-dimethylmorpholin-4-yl)methanone;(3,3-dimethylmorpholin-4-yl)-[1-(3,5-dimethylthiophen-2-yl)-7-methoxy-8-propan-2-yloxy-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone is sourced from PubChem (CID 159633078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).