1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one

C₁₂₈H₁₂₀F₃N₁₇O₇ — CID 157133861

About 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one

1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one (PubChem CID 157133861) has the molecular formula C₁₂₈H₁₂₀F₃N₁₇O₇ and a molecular weight of 2065.47 g/mol. Its IUPAC name is 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one.

Molecular Properties

• Compound Name: 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one
• PubChem CID: 157133861
• Molecular Formula: C₁₂₈H₁₂₀F₃N₁₇O₇
• Molecular Weight: 2065.47 g/mol
• Exact Mass: 2063.95
• IUPAC Name: 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one
• SMILES: Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CC3CCCN3C5)c(=O)c2)cc1.Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CCN3CCCC53)c(=O)c2)cc1.Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CCN3CCCC53)c(=O)c2)cn1.O=c1cc(OCc2ccc(F)cc2F)ccn1-c1ccc2c3c([nH]c2c1)CCN1CCCC31.O=c1cc(OCc2ccc(F)cn2)ccn1-c1ccc2c3c([nH]c2c1)CC1CCCN1C3
• InChI: InChI=1S/C26H23F2N3O2.2C26H25N3O.C25H23FN4O2.C25H24N4O/c27-17-4-3-16(21(28)12-17)15-33-19-7-11-31(25(32)14-19)18-5-6-20-23(13-18)29-22-8-10-30-9-1-2-24(30)26(20)22;1-17-4-6-18(7-5-17)19-10-14-29(25(30)15-19)20-8-9-21-23(16-20)27-22-11-13-28-12-2-3-24(28)26(21)22;1-17-4-6-18(7-5-17)19-10-12-29(26(30)13-19)21-8-9-22-23-16-28-11-2-3-20(28)14-25(23)27-24(22)15-21;26-16-3-4-17(27-13-16)15-32-20-7-9-30(25(31)12-20)19-5-6-21-22-14-29-8-1-2-18(29)10-24(22)28-23(21)11-19;1-16-4-5-18(15-26-16)17-8-12-29(24(30)13-17)19-6-7-20-22(14-19)27-21-9-11-28-10-2-3-23(28)25(20)21/h3-7,11-14,24,29H,1-2,8-10,15H2;4-10,14-16,24,27H,2-3,11-13H2,1H3;4-10,12-13,15,20,27H,2-3,11,14,16H2,1H3;3-7,9,11-13,18,28H,1-2,8,10,14-15H2;4-8,12-15,23,27H,2-3,9-11H2,1H3
• InChIKey: AJJUFZPMFRFITC-UHFFFAOYSA-N
• XLogP: 23.01
• TPSA: 249.39 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 19
• Rotatable Bonds: 14
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2065.47
LogP ≤ 5	23.01
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one?

The IUPAC name of 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one (CID 157133861) is 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one.

What is the SMILES notation for 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one?

The canonical SMILES for 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one is Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CC3CCCN3C5)c(=O)c2)cc1.Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CCN3CCCC53)c(=O)c2)cc1.Cc1ccc(-c2ccn(-c3ccc4c5c([nH]c4c3)CCN3CCCC53)c(=O)c2)cn1.O=c1cc(OCc2ccc(F)cc2F)ccn1-c1ccc2c3c([nH]c2c1)CCN1CCCC31.O=c1cc(OCc2ccc(F)cn2)ccn1-c1ccc2c3c([nH]c2c1)CC1CCCN1C3.

What is the InChIKey of 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one?

The InChIKey is AJJUFZPMFRFITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23F2N3O2.2C26H25N3O.C25H23FN4O2.C25H24N4O/c27-17-4-3-16(21(28)12-17)15-33-19-7-11-31(25(32)14-19)18-5-6-20-23(13-18)29-22-8-10-30-9-1-2-24(30)26(20)22;1-17-4-6-18(7-5-17)19-10-14-29(25(30)15-19)20-8-9-21-23(16-20)27-22-11-13-28-12-2-3-24(28)26(21)22;1-17-4-6-18(7-5-17)19-10-12-29(26(30)13-19)21-8-9-22-23-16-28-11-2-3-20(28)14-25(23)27-24(22)15-21;26-16-3-4-17(27-13-16)15-32-20-7-9-30(25(31)12-20)19-5-6-21-22-14-29-8-1-2-18(29)10-24(22)28-23(21)11-19;1-16-4-5-18(15-26-16)17-8-12-29(24(30)13-17)19-6-7-20-22(14-19)27-21-9-11-28-10-2-3-23(28)25(20)21/h3-7,11-14,24,29H,1-2,8-10,15H2;4-10,14-16,24,27H,2-3,11-13H2,1H3;4-10,12-13,15,20,27H,2-3,11,14,16H2,1H3;3-7,9,11-13,18,28H,1-2,8,10,14-15H2;4-8,12-15,23,27H,2-3,9-11H2,1H3.

What are the key properties of 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one?

1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one has a molecular weight of 2065.47 g/mol, XLogP of 23.01, 14 rotatable bonds, 5 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-[(5-fluoro-2-pyridinyl)methoxy]pyridin-2-one;1-(2,3,5,10,11,11a-hexahydro-1H-indolizino[7,6-b]indol-8-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-[(2,4-difluorophenyl)methoxy]pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(4-methylphenyl)pyridin-2-one;1-(2,3,5,6,7,11c-hexahydro-1H-indolizino[7,8-b]indol-9-yl)-4-(6-methyl-3-pyridinyl)pyridin-2-one is sourced from PubChem (CID 157133861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 157133861 — identifiers, structure, computed properties (public domain)

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