1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one

C₁₅₂H₁₄₉FN₁₆O₁₁ — CID 158307989

About 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one

1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one (PubChem CID 158307989) has the molecular formula C₁₅₂H₁₄₉FN₁₆O₁₁ and a molecular weight of 2394.96 g/mol. Its IUPAC name is 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one.

Molecular Properties

• Compound Name: 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one
• PubChem CID: 158307989
• Molecular Formula: C₁₅₂H₁₄₉FN₁₆O₁₁
• Molecular Weight: 2394.96 g/mol
• Exact Mass: 2393.16
• IUPAC Name: 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one
• SMILES: CC(=O)N1Cc2c(n(C)c3cc(-n4ccc(OCc5ccccc5)cc4=O)ccc23)C(C)C1.CC1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc3n2C)CCN1C.CCOCn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CNCC2.CN1CCc2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc3n2C)C1.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCCC5)c(=O)c2)c(F)c1.Cn1c2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc31)CCCC2
• InChI: InChI=1S/C27H27N3O3.C26H27N3O3.C26H27N3O2.C25H23FN2O.C24H23N3O.C24H22N2O/c1-18-15-29(19(2)31)16-24-23-10-9-21(13-25(23)28(3)27(18)24)30-12-11-22(14-26(30)32)33-17-20-7-5-4-6-8-20;1-2-31-18-29-24-10-12-27-16-23(24)22-9-8-20(14-25(22)29)28-13-11-21(15-26(28)30)32-17-19-6-4-3-5-7-19;1-18-26-23(12-13-27(18)2)22-10-9-20(15-24(22)28(26)3)29-14-11-21(16-25(29)30)31-17-19-7-5-4-6-8-19;1-16-7-9-19(22(26)13-16)17-11-12-28(25(29)14-17)18-8-10-21-20-5-3-4-6-23(20)27(2)24(21)15-18;1-25-12-11-22-21(16-25)20-9-8-19(15-23(20)26(22)2)27-13-10-18(14-24(27)28)17-6-4-3-5-7-17;1-25-22-10-6-5-9-20(22)21-12-11-19(16-23(21)25)26-14-13-18(15-24(26)27)17-7-3-2-4-8-17/h4-14,18H,15-17H2,1-3H3;3-9,11,13-15,27H,2,10,12,16-18H2,1H3;4-11,14-16,18H,12-13,17H2,1-3H3;7-15H,3-6H2,1-2H3;3-10,13-15H,11-12,16H2,1-2H3;2-4,7-8,11-16H,5-6,9-10H2,1H3
• InChIKey: GNICIDNBHDFXJK-UHFFFAOYSA-N
• XLogP: 27.02
• TPSA: 237.32 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 21
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2394.96
LogP ≤ 5	27.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?

The IUPAC name of 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one (CID 158307989) is 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one.

What is the SMILES notation for 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?

The canonical SMILES for 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one is CC(=O)N1Cc2c(n(C)c3cc(-n4ccc(OCc5ccccc5)cc4=O)ccc23)C(C)C1.CC1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc3n2C)CCN1C.CCOCn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CNCC2.CN1CCc2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc3n2C)C1.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCCC5)c(=O)c2)c(F)c1.Cn1c2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc31)CCCC2.

What is the InChIKey of 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?

The InChIKey is GNICIDNBHDFXJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27N3O3.C26H27N3O3.C26H27N3O2.C25H23FN2O.C24H23N3O.C24H22N2O/c1-18-15-29(19(2)31)16-24-23-10-9-21(13-25(23)28(3)27(18)24)30-12-11-22(14-26(30)32)33-17-20-7-5-4-6-8-20;1-2-31-18-29-24-10-12-27-16-23(24)22-9-8-20(14-25(22)29)28-13-11-21(15-26(28)30)32-17-19-6-4-3-5-7-19;1-18-26-23(12-13-27(18)2)22-10-9-20(15-24(22)28(26)3)29-14-11-21(16-25(29)30)31-17-19-7-5-4-6-8-19;1-16-7-9-19(22(26)13-16)17-11-12-28(25(29)14-17)18-8-10-21-20-5-3-4-6-23(20)27(2)24(21)15-18;1-25-12-11-22-21(16-25)20-9-8-19(15-23(20)26(22)2)27-13-10-18(14-24(27)28)17-6-4-3-5-7-17;1-25-22-10-6-5-9-20(22)21-12-11-19(16-23(21)25)26-14-13-18(15-24(26)27)17-7-3-2-4-8-17/h4-14,18H,15-17H2,1-3H3;3-9,11,13-15,27H,2,10,12,16-18H2,1H3;4-11,14-16,18H,12-13,17H2,1-3H3;7-15H,3-6H2,1-2H3;3-10,13-15H,11-12,16H2,1-2H3;2-4,7-8,11-16H,5-6,9-10H2,1H3.

What are the key properties of 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?

1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one has a molecular weight of 2394.96 g/mol, XLogP of 27.02, 21 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2-acetyl-4,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-(2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(2-fluoro-4-methylphenyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one is sourced from PubChem (CID 158307989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158307989 — identifiers, structure, computed properties (public domain)

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