2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide

C148H143Cl5F13N29O18 — CID 159346850

About 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide

2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide (PubChem CID 159346850) has the molecular formula C148H143Cl5F13N29O18 and a molecular weight of 3040.20 g/mol. Its IUPAC name is 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide.

Molecular Properties

• Compound Name: 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide
• PubChem CID: 159346850
• Molecular Formula: C148H143Cl5F13N29O18
• Molecular Weight: 3040.20 g/mol
• Exact Mass: 3035.94
• IUPAC Name: 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide
• SMILES: CCN1CCN(c2cc(C(=O)Nc3cnc(C)c(-c4cc(N5CCOCC5)c(=O)n(C)c4)c3)cc(C(F)(F)F)c2)CC1.Cc1ncc(NC(=O)c2cccc(C3(C#N)CC3)c2Cl)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cn1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3cccc(C(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3ccnc(C(C)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3ccnc(C(F)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O
• InChI: InChI=1S/C30H35F3N6O3.C27H26ClN5O3.C23H20ClF3N4O3.C23H22ClF2N5O3.C23H21ClF2N4O3.C22H19ClF3N5O3/c1-4-37-5-7-38(8-6-37)25-14-21(13-23(16-25)30(31,32)33)28(40)35-24-17-26(20(2)34-18-24)22-15-27(29(41)36(3)19-22)39-9-11-42-12-10-39;1-17-21(18-12-23(26(35)32(2)15-18)33-8-10-36-11-9-33)13-19(14-30-17)31-25(34)20-4-3-5-22(24(20)28)27(16-29)6-7-27;1-30-13-15(10-19(22(30)33)31-5-7-34-8-6-31)18-11-17(12-28-20(18)24)29-21(32)14-3-2-4-16(9-14)23(25,26)27;1-23(25,26)19-10-14(3-4-27-19)21(32)29-16-11-17(20(24)28-12-16)15-9-18(22(33)30(2)13-15)31-5-7-34-8-6-31;1-29-13-16(10-19(23(29)32)30-5-7-33-8-6-30)18-11-17(12-27-20(18)24)28-22(31)15-4-2-3-14(9-15)21(25)26;1-30-12-14(8-17(21(30)33)31-4-6-34-7-5-31)16-10-15(11-28-19(16)23)29-20(32)13-2-3-27-18(9-13)22(24,25)26/h13-19H,4-12H2,1-3H3,(H,35,40);3-5,12-15H,6-11H2,1-2H3,(H,31,34);2-4,9-13H,5-8H2,1H3,(H,29,32);3-4,9-13H,5-8H2,1-2H3,(H,29,32);2-4,9-13,21H,5-8H2,1H3,(H,28,31);2-3,8-12H,4-7H2,1H3,(H,29,32)
• InChIKey: LGVFXXQWKOUBSW-UHFFFAOYSA-N
• XLogP: 23.69
• TPSA: 514.81 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 41
• Rotatable Bonds: 29
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3040.20
LogP ≤ 5	23.69
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide?

The IUPAC name of 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide (CID 159346850) is 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide.

What is the SMILES notation for 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide?

The canonical SMILES for 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide is CCN1CCN(c2cc(C(=O)Nc3cnc(C)c(-c4cc(N5CCOCC5)c(=O)n(C)c4)c3)cc(C(F)(F)F)c2)CC1.Cc1ncc(NC(=O)c2cccc(C3(C#N)CC3)c2Cl)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cn1cc(-c2cc(NC(=O)c3cccc(C(F)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3cccc(C(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3ccnc(C(C)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.Cn1cc(-c2cc(NC(=O)c3ccnc(C(F)(F)F)c3)cnc2Cl)cc(N2CCOCC2)c1=O.

What is the InChIKey of 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide?

The InChIKey is LGVFXXQWKOUBSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35F3N6O3.C27H26ClN5O3.C23H20ClF3N4O3.C23H22ClF2N5O3.C23H21ClF2N4O3.C22H19ClF3N5O3/c1-4-37-5-7-38(8-6-37)25-14-21(13-23(16-25)30(31,32)33)28(40)35-24-17-26(20(2)34-18-24)22-15-27(29(41)36(3)19-22)39-9-11-42-12-10-39;1-17-21(18-12-23(26(35)32(2)15-18)33-8-10-36-11-9-33)13-19(14-30-17)31-25(34)20-4-3-5-22(24(20)28)27(16-29)6-7-27;1-30-13-15(10-19(22(30)33)31-5-7-34-8-6-31)18-11-17(12-28-20(18)24)29-21(32)14-3-2-4-16(9-14)23(25,26)27;1-23(25,26)19-10-14(3-4-27-19)21(32)29-16-11-17(20(24)28-12-16)15-9-18(22(33)30(2)13-15)31-5-7-34-8-6-31;1-29-13-16(10-19(23(29)32)30-5-7-33-8-6-30)18-11-17(12-27-20(18)24)28-22(31)15-4-2-3-14(9-15)21(25)26;1-30-12-14(8-17(21(30)33)31-4-6-34-7-5-31)16-10-15(11-28-19(16)23)29-20(32)13-2-3-27-18(9-13)22(24,25)26/h13-19H,4-12H2,1-3H3,(H,35,40);3-5,12-15H,6-11H2,1-2H3,(H,31,34);2-4,9-13H,5-8H2,1H3,(H,29,32);3-4,9-13H,5-8H2,1-2H3,(H,29,32);2-4,9-13,21H,5-8H2,1H3,(H,28,31);2-3,8-12H,4-7H2,1H3,(H,29,32).

What are the key properties of 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide?

2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide has a molecular weight of 3040.20 g/mol, XLogP of 23.69, 29 rotatable bonds, 6 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-3-(1-cyanocyclopropyl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(1,1-difluoroethyl)pyridine-4-carboxamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(difluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[6-chloro-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;3-(4-ethylpiperazin-1-yl)-N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)-3-pyridinyl]-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 159346850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).