potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane

C85H92BrKN14O11 — CID 161134883

About potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane

potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane (PubChem CID 161134883) has the molecular formula C85H92BrKN14O11 and a molecular weight of 1604.76 g/mol. Its IUPAC name is potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane.

Molecular Properties

• Compound Name: potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane
• PubChem CID: 161134883
• Molecular Formula: C85H92BrKN14O11
• Molecular Weight: 1604.76 g/mol
• Exact Mass: 1602.59
• IUPAC Name: potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane
• SMILES: BrCc1cccnc1.C1CCOC1.CC(C)(C)[O-].CN(C)CCCn1nc(C2=C(c3cn(-c4ccncc4)c4ccccc34)C(=O)NC2=O)c2ccccc21.CN(C)CCCn1nc(CC(N)=O)c2ccccc21.COC(=O)C(=O)c1c[nH]c2ccccc12.COC(=O)C(=O)c1cn(Cc2cccnc2)c2ccccc12.[K+]
• InChI: InChI=1S/C29H26N6O2.C17H14N2O3.C14H20N4O.C11H9NO3.C6H6BrN.C4H8O.C4H9O.K/c1-33(2)16-7-17-35-24-11-6-4-9-21(24)27(32-35)26-25(28(36)31-29(26)37)22-18-34(19-12-14-30-15-13-19)23-10-5-3-8-20(22)23;1-22-17(21)16(20)14-11-19(10-12-5-4-8-18-9-12)15-7-3-2-6-13(14)15;1-17(2)8-5-9-18-13-7-4-3-6-11(13)12(16-18)10-14(15)19;1-15-11(14)10(13)8-6-12-9-5-3-2-4-7(8)9;7-4-6-2-1-3-8-5-6;1-2-4-5-3-1;1-4(2,3)5;/h3-6,8-15,18H,7,16-17H2,1-2H3,(H,31,36,37);2-9,11H,10H2,1H3;3-4,6-7H,5,8-10H2,1-2H3,(H2,15,19);2-6,12H,1H3;1-3,5H,4H2;1-4H2;1-3H3;/q;;;;;;-1;+1
• InChIKey: UMQVFQZYQSUVOC-UHFFFAOYSA-N
• XLogP: 8.80
• TPSA: 314.73 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 22
• Rotatable Bonds: 20
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1604.76
LogP ≤ 5	8.80
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane?

The IUPAC name of potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane (CID 161134883) is potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane.

What is the SMILES notation for potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane?

The canonical SMILES for potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane is BrCc1cccnc1.C1CCOC1.CC(C)(C)[O-].CN(C)CCCn1nc(C2=C(c3cn(-c4ccncc4)c4ccccc34)C(=O)NC2=O)c2ccccc21.CN(C)CCCn1nc(CC(N)=O)c2ccccc21.COC(=O)C(=O)c1c[nH]c2ccccc12.COC(=O)C(=O)c1cn(Cc2cccnc2)c2ccccc12.[K+].

What is the InChIKey of potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane?

The InChIKey is UMQVFQZYQSUVOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N6O2.C17H14N2O3.C14H20N4O.C11H9NO3.C6H6BrN.C4H8O.C4H9O.K/c1-33(2)16-7-17-35-24-11-6-4-9-21(24)27(32-35)26-25(28(36)31-29(26)37)22-18-34(19-12-14-30-15-13-19)23-10-5-3-8-20(22)23;1-22-17(21)16(20)14-11-19(10-12-5-4-8-18-9-12)15-7-3-2-6-13(14)15;1-17(2)8-5-9-18-13-7-4-3-6-11(13)12(16-18)10-14(15)19;1-15-11(14)10(13)8-6-12-9-5-3-2-4-7(8)9;7-4-6-2-1-3-8-5-6;1-2-4-5-3-1;1-4(2,3)5;/h3-6,8-15,18H,7,16-17H2,1-2H3,(H,31,36,37);2-9,11H,10H2,1H3;3-4,6-7H,5,8-10H2,1-2H3,(H2,15,19);2-6,12H,1H3;1-3,5H,4H2;1-4H2;1-3H3;/q;;;;;;-1;+1.

What are the key properties of potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane?

potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane has a molecular weight of 1604.76 g/mol, XLogP of 8.80, 20 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;3-(bromomethyl)pyridine;2-[1-[3-(dimethylamino)propyl]indazol-3-yl]acetamide;3-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(1-pyridin-4-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1H-indol-3-yl)-2-oxoacetate;methyl 2-oxo-2-[1-(pyridin-3-ylmethyl)indol-3-yl]acetate;2-methylpropan-2-olate;oxolane is sourced from PubChem (CID 161134883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).