2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one

C134H145ClF10N10O19S — CID 157464072

About 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one

2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one (PubChem CID 157464072) has the molecular formula C134H145ClF10N10O19S and a molecular weight of 2457.18 g/mol. Its IUPAC name is 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one.

Molecular Properties

• Compound Name: 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one
• PubChem CID: 157464072
• Molecular Formula: C134H145ClF10N10O19S
• Molecular Weight: 2457.18 g/mol
• Exact Mass: 2454.99
• IUPAC Name: 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one
• SMILES: COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1F)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1NC(=O)C(C)(C)C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cnc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(C(F)(F)F)nc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(SC)cc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ncccc1C)C2=O
• InChI: InChI=1S/C27H31F3N2O4.C22H21F4NO3.C22H25NO3S.C21H23ClN2O3.C21H21F3N2O3.C21H24N2O3/c1-26(2,3)25(34)31-21-6-5-19(27(28,29)30)13-17(21)12-18-11-16-14-22(32-7-9-36-10-8-32)23(35-4)15-20(16)24(18)33;1-29-20-12-17-13(11-19(20)27-4-6-30-7-5-27)8-15(21(17)28)9-14-10-16(22(24,25)26)2-3-18(14)23;1-25-21-14-19-16(13-20(21)23-7-9-26-10-8-23)12-17(22(19)24)11-15-3-5-18(27-2)6-4-15;1-13-7-16(21(22)23-12-13)9-15-8-14-10-18(24-3-5-27-6-4-24)19(26-2)11-17(14)20(15)25;1-28-18-11-16-14(10-17(18)26-4-6-29-7-5-26)9-15(20(16)27)8-13-2-3-19(25-12-13)21(22,23)24;1-14-4-3-5-22-18(14)11-16-10-15-12-19(23-6-8-26-9-7-23)20(25-2)13-17(15)21(16)24/h5-6,13-15,18H,7-12H2,1-4H3,(H,31,34);2-3,10-12,15H,4-9H2,1H3;3-6,13-14,17H,7-12H2,1-2H3;7,10-12,15H,3-6,8-9H2,1-2H3;2-3,10-12,15H,4-9H2,1H3;3-5,12-13,16H,6-11H2,1-2H3
• InChIKey: BUGOPPZRUTZGJU-UHFFFAOYSA-N
• XLogP: 23.13
• TPSA: 300.39 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 29
• Rotatable Bonds: 26
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2457.18
LogP ≤ 5	23.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?

The IUPAC name of 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one (CID 157464072) is 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one.

What is the SMILES notation for 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?

The canonical SMILES for 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one is COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1F)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C(F)(F)F)ccc1NC(=O)C(C)(C)C)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1cc(C)cnc1Cl)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(C(F)(F)F)nc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ccc(SC)cc1)C2=O.COc1cc2c(cc1N1CCOCC1)CC(Cc1ncccc1C)C2=O.

What is the InChIKey of 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?

The InChIKey is BUGOPPZRUTZGJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31F3N2O4.C22H21F4NO3.C22H25NO3S.C21H23ClN2O3.C21H21F3N2O3.C21H24N2O3/c1-26(2,3)25(34)31-21-6-5-19(27(28,29)30)13-17(21)12-18-11-16-14-22(32-7-9-36-10-8-32)23(35-4)15-20(16)24(18)33;1-29-20-12-17-13(11-19(20)27-4-6-30-7-5-27)8-15(21(17)28)9-14-10-16(22(24,25)26)2-3-18(14)23;1-25-21-14-19-16(13-20(21)23-7-9-26-10-8-23)12-17(22(19)24)11-15-3-5-18(27-2)6-4-15;1-13-7-16(21(22)23-12-13)9-15-8-14-10-18(24-3-5-27-6-4-24)19(26-2)11-17(14)20(15)25;1-28-18-11-16-14(10-17(18)26-4-6-29-7-5-26)9-15(20(16)27)8-13-2-3-19(25-12-13)21(22,23)24;1-14-4-3-5-22-18(14)11-16-10-15-12-19(23-6-8-26-9-7-23)20(25-2)13-17(15)21(16)24/h5-6,13-15,18H,7-12H2,1-4H3,(H,31,34);2-3,10-12,15H,4-9H2,1H3;3-6,13-14,17H,7-12H2,1-2H3;7,10-12,15H,3-6,8-9H2,1-2H3;2-3,10-12,15H,4-9H2,1H3;3-5,12-13,16H,6-11H2,1-2H3.

What are the key properties of 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one?

2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one has a molecular weight of 2457.18 g/mol, XLogP of 23.13, 26 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2-chloro-5-methyl-3-pyridinyl)methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;2-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methoxy-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(3-methyl-2-pyridinyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;6-methoxy-2-[(4-methylsulfanylphenyl)methyl]-5-morpholin-4-yl-2,3-dihydroinden-1-one;N-[2-[(5-methoxy-6-morpholin-4-yl-3-oxo-1,2-dihydroinden-2-yl)methyl]-4-(trifluoromethyl)phenyl]-2,2-dimethylpropanamide;6-methoxy-5-morpholin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-2,3-dihydroinden-1-one is sourced from PubChem (CID 157464072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).