dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate

C102H98Cl2F5K2N23O16 — CID 161404135

About dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate

dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate (PubChem CID 161404135) has the molecular formula C102H98Cl2F5K2N23O16 and a molecular weight of 2146.14 g/mol. Its IUPAC name is dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate.

Molecular Properties

• Compound Name: dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate
• PubChem CID: 161404135
• Molecular Formula: C102H98Cl2F5K2N23O16
• Molecular Weight: 2146.14 g/mol
• Exact Mass: 2143.61
• IUPAC Name: dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate
• SMILES: CC(=O)CCl.CC(=O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C.CCOC(=O)c1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C.Cc1cc2c(F)c(O)ccc2[nH]1.Cc1cc2c(F)c(Oc3ncnn4cc(C(C)(C)O)c(C)c34)ccc2[nH]1.Cc1cc2c(F)c(Oc3ncnn4cc(O)c(C)c34)ccc2[nH]1.Cc1cn2nc[nH]c(=O)c2c1C.Cc1cn2ncnc(Cl)c2c1C.O=CO[O-].[H-].[K+].[K+]
• InChI: InChI=1S/2C19H17FN4O3.C19H19FN4O2.C16H13FN4O2.C9H8FNO.C8H8ClN3.C8H9N3O.C3H5ClO.CH2O3.2K.H/c1-10-6-13-14(23-10)4-5-15(17(13)20)27-19-18-12(3)16(26-8-11(2)25)7-24(18)22-9-21-19;1-4-26-19(25)13-8-24-17(11(13)3)18(21-9-22-24)27-15-6-5-14-12(16(15)20)7-10(2)23-14;1-10-7-12-14(23-10)5-6-15(16(12)20)26-18-17-11(2)13(19(3,4)25)8-24(17)22-9-21-18;1-8-5-10-11(20-8)3-4-13(14(10)17)23-16-15-9(2)12(22)6-21(15)19-7-18-16;1-5-4-6-7(11-5)2-3-8(12)9(6)10;1-5-3-12-7(6(5)2)8(9)10-4-11-12;1-5-3-11-7(6(5)2)8(12)9-4-10-11;1-3(5)2-4;2-1-4-3;;;/h4-7,9,23H,8H2,1-3H3;5-9,23H,4H2,1-3H3;5-9,23,25H,1-4H3;3-7,20,22H,1-2H3;2-4,11-12H,1H3;3-4H,1-2H3;3-4H,1-2H3,(H,9,10,12);2H2,1H3;1,3H;;;/q;;;;;;;;;2*+1;-1/p-1
• InChIKey: YEFVKCLUCUCXBI-UHFFFAOYSA-M
• XLogP: 13.44
• TPSA: 496.70 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 33
• Rotatable Bonds: 16
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2146.14
LogP ≤ 5	13.44
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate?

The IUPAC name of dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate (CID 161404135) is dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate.

What is the SMILES notation for dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate?

The canonical SMILES for dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate is CC(=O)CCl.CC(=O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C.CCOC(=O)c1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C.Cc1cc2c(F)c(O)ccc2[nH]1.Cc1cc2c(F)c(Oc3ncnn4cc(C(C)(C)O)c(C)c34)ccc2[nH]1.Cc1cc2c(F)c(Oc3ncnn4cc(O)c(C)c34)ccc2[nH]1.Cc1cn2nc[nH]c(=O)c2c1C.Cc1cn2ncnc(Cl)c2c1C.O=CO[O-].[H-].[K+].[K+].

What is the InChIKey of dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate?

The InChIKey is YEFVKCLUCUCXBI-UHFFFAOYSA-M. The full InChI is InChI=1S/2C19H17FN4O3.C19H19FN4O2.C16H13FN4O2.C9H8FNO.C8H8ClN3.C8H9N3O.C3H5ClO.CH2O3.2K.H/c1-10-6-13-14(23-10)4-5-15(17(13)20)27-19-18-12(3)16(26-8-11(2)25)7-24(18)22-9-21-19;1-4-26-19(25)13-8-24-17(11(13)3)18(21-9-22-24)27-15-6-5-14-12(16(15)20)7-10(2)23-14;1-10-7-12-14(23-10)5-6-15(16(12)20)26-18-17-11(2)13(19(3,4)25)8-24(17)22-9-21-18;1-8-5-10-11(20-8)3-4-13(14(10)17)23-16-15-9(2)12(22)6-21(15)19-7-18-16;1-5-4-6-7(11-5)2-3-8(12)9(6)10;1-5-3-12-7(6(5)2)8(9)10-4-11-12;1-5-3-11-7(6(5)2)8(12)9-4-10-11;1-3(5)2-4;2-1-4-3;;;/h4-7,9,23H,8H2,1-3H3;5-9,23H,4H2,1-3H3;5-9,23,25H,1-4H3;3-7,20,22H,1-2H3;2-4,11-12H,1H3;3-4H,1-2H3;3-4H,1-2H3,(H,9,10,12);2H2,1H3;1,3H;;;/q;;;;;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate?

dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate has a molecular weight of 2146.14 g/mol, XLogP of 13.44, 16 rotatable bonds, 9 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;4-chloro-5,6-dimethylpyrrolo[2,1-f][1,2,4]triazine;1-chloropropan-2-one;5,6-dimethyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one;ethyl 4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate;4-fluoro-2-methyl-1H-indol-5-ol;4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-ol;1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-one;2-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]propan-2-ol;hydride;oxido formate is sourced from PubChem (CID 161404135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).