4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one

C129H128ClF4N15O9 — CID 159006934

About 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one

4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one (PubChem CID 159006934) has the molecular formula C129H128ClF4N15O9 and a molecular weight of 2143.98 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one.

Molecular Properties

• Compound Name: 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one
• PubChem CID: 159006934
• Molecular Formula: C129H128ClF4N15O9
• Molecular Weight: 2143.98 g/mol
• Exact Mass: 2141.96
• IUPAC Name: 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one
• SMILES: Cc1ccc(COc2ccn(-c3ccc4c5c(n(C)c4c3)CCNC5)c(=O)c2)cc1.Cn1c2c(c3ccc(-n4ccc(CCc5ccccc5)cc4=O)cc31)CNCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccc(Cl)cc5)cc4=O)cc31)CNCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CN(CC(C)(F)F)CC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CN(CCC(C)(F)F)CC2
• InChI: InChI=1S/C28H29F2N3O2.C27H27F2N3O2.C25H25N3O2.C25H25N3O.C24H22ClN3O2/c1-28(29,30)12-15-32-13-11-25-24(18-32)23-9-8-21(16-26(23)31(25)2)33-14-10-22(17-27(33)34)35-19-20-6-4-3-5-7-20;1-27(28,29)18-31-12-11-24-23(16-31)22-9-8-20(14-25(22)30(24)2)32-13-10-21(15-26(32)33)34-17-19-6-4-3-5-7-19;1-17-3-5-18(6-4-17)16-30-20-10-12-28(25(29)14-20)19-7-8-21-22-15-26-11-9-23(22)27(2)24(21)13-19;1-27-23-11-13-26-17-22(23)21-10-9-20(16-24(21)27)28-14-12-19(15-25(28)29)8-7-18-5-3-2-4-6-18;1-27-22-8-10-26-14-21(22)20-7-6-18(12-23(20)27)28-11-9-19(13-24(28)29)30-15-16-2-4-17(25)5-3-16/h3-10,14,16-17H,11-13,15,18-19H2,1-2H3;3-10,13-15H,11-12,16-18H2,1-2H3;3-8,10,12-14,26H,9,11,15-16H2,1-2H3;2-6,9-10,12,14-16,26H,7-8,11,13,17H2,1H3;2-7,9,11-13,26H,8,10,14-15H2,1H3
• InChIKey: JSAPCRIXAYJMPA-UHFFFAOYSA-N
• XLogP: 22.06
• TPSA: 214.14 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 24
• Rotatable Bonds: 25
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2143.98
LogP ≤ 5	22.06
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one?

The IUPAC name of 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one (CID 159006934) is 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one.

What is the SMILES notation for 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one?

The canonical SMILES for 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one is Cc1ccc(COc2ccn(-c3ccc4c5c(n(C)c4c3)CCNC5)c(=O)c2)cc1.Cn1c2c(c3ccc(-n4ccc(CCc5ccccc5)cc4=O)cc31)CNCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccc(Cl)cc5)cc4=O)cc31)CNCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CN(CC(C)(F)F)CC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CN(CCC(C)(F)F)CC2.

What is the InChIKey of 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one?

The InChIKey is JSAPCRIXAYJMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29F2N3O2.C27H27F2N3O2.C25H25N3O2.C25H25N3O.C24H22ClN3O2/c1-28(29,30)12-15-32-13-11-25-24(18-32)23-9-8-21(16-26(23)31(25)2)33-14-10-22(17-27(33)34)35-19-20-6-4-3-5-7-20;1-27(28,29)18-31-12-11-24-23(16-31)22-9-8-20(14-25(22)30(24)2)32-13-10-21(15-26(32)33)34-17-19-6-4-3-5-7-19;1-17-3-5-18(6-4-17)16-30-20-10-12-28(25(29)14-20)19-7-8-21-22-15-26-11-9-23(22)27(2)24(21)13-19;1-27-23-11-13-26-17-22(23)21-10-9-20(16-24(21)27)28-14-12-19(15-25(28)29)8-7-18-5-3-2-4-6-18;1-27-22-8-10-26-14-21(22)20-7-6-18(12-23(20)27)28-11-9-19(13-24(28)29)30-15-16-2-4-17(25)5-3-16/h3-10,14,16-17H,11-13,15,18-19H2,1-2H3;3-10,13-15H,11-12,16-18H2,1-2H3;3-8,10,12-14,26H,9,11,15-16H2,1-2H3;2-6,9-10,12,14-16,26H,7-8,11,13,17H2,1H3;2-7,9,11-13,26H,8,10,14-15H2,1H3.

What are the key properties of 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one?

4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one has a molecular weight of 2143.98 g/mol, XLogP of 22.06, 25 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(4-chlorophenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-[2-(3,3-difluorobutyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;1-[2-(2,2-difluoropropyl)-5-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-[(4-methylphenyl)methoxy]-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-(2-phenylethyl)pyridin-2-one is sourced from PubChem (CID 159006934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).