4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine

C66H63ClF4N10O4 — CID 159022915

About 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine

4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine (PubChem CID 159022915) has the molecular formula C66H63ClF4N10O4 and a molecular weight of 1171.74 g/mol. Its IUPAC name is 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine.

Molecular Properties

• Compound Name: 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine
• PubChem CID: 159022915
• Molecular Formula: C66H63ClF4N10O4
• Molecular Weight: 1171.74 g/mol
• Exact Mass: 1170.47
• IUPAC Name: 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine
• SMILES: COc1cc(C)c(-c2ncc(N3CCOCC3)cc2N)c(C)c1.COc1cc(C)c(-c2ncc(N3CCOCC3)cc2Nc2c(C)c(-c3ccccn3)nc3cc(F)cc(F)c23)c(C)c1.Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Cl
• InChI: InChI=1S/C33H31F2N5O2.C18H23N3O2.C15H9ClF2N2/c1-19-13-24(41-4)14-20(2)29(19)33-28(17-23(18-37-33)40-9-11-42-12-10-40)39-32-21(3)31(26-7-5-6-8-36-26)38-27-16-22(34)15-25(35)30(27)32;1-12-8-15(22-3)9-13(2)17(12)18-16(19)10-14(11-20-18)21-4-6-23-7-5-21;1-8-14(16)13-10(18)6-9(17)7-12(13)20-15(8)11-4-2-3-5-19-11/h5-8,13-18H,9-12H2,1-4H3,(H,38,39);8-11H,4-7,19H2,1-3H3;2-7H,1H3
• InChIKey: JTXPMOYFXVQPLC-UHFFFAOYSA-N
• XLogP: 14.48
• TPSA: 158.79 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 14
• Rotatable Bonds: 10
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1171.74
LogP ≤ 5	14.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine?

The IUPAC name of 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine (CID 159022915) is 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine.

What is the SMILES notation for 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine?

The canonical SMILES for 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine is COc1cc(C)c(-c2ncc(N3CCOCC3)cc2N)c(C)c1.COc1cc(C)c(-c2ncc(N3CCOCC3)cc2Nc2c(C)c(-c3ccccn3)nc3cc(F)cc(F)c23)c(C)c1.Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1Cl.

What is the InChIKey of 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine?

The InChIKey is JTXPMOYFXVQPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H31F2N5O2.C18H23N3O2.C15H9ClF2N2/c1-19-13-24(41-4)14-20(2)29(19)33-28(17-23(18-37-33)40-9-11-42-12-10-40)39-32-21(3)31(26-7-5-6-8-36-26)38-27-16-22(34)15-25(35)30(27)32;1-12-8-15(22-3)9-13(2)17(12)18-16(19)10-14(11-20-18)21-4-6-23-7-5-21;1-8-14(16)13-10(18)6-9(17)7-12(13)20-15(8)11-4-2-3-5-19-11/h5-8,13-18H,9-12H2,1-4H3,(H,38,39);8-11H,4-7,19H2,1-3H3;2-7H,1H3.

What are the key properties of 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine?

4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine has a molecular weight of 1171.74 g/mol, XLogP of 14.48, 10 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-5,7-difluoro-3-methyl-2-pyridin-2-ylquinoline;5,7-difluoro-N-[2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-yl-3-pyridinyl]-3-methyl-2-pyridin-2-ylquinolin-4-amine;2-(4-methoxy-2,6-dimethylphenyl)-5-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 159022915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).