potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide

C53H75KN14O6 — CID 160547721

About potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide

potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide (PubChem CID 160547721) has the molecular formula C53H75KN14O6 and a molecular weight of 1043.37 g/mol. Its IUPAC name is potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide.

Molecular Properties

• Compound Name: potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide
• PubChem CID: 160547721
• Molecular Formula: C53H75KN14O6
• Molecular Weight: 1043.37 g/mol
• Exact Mass: 1042.56
• IUPAC Name: potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide
• SMILES: CN1CCNCC1.CO.COc1cc2c(nc1OC)c(-c1cc3cccnc3[nH]1)cn2CCN1CCN(C)CC1.COc1cc2c(nc1OC)c(-c1cc3cccnc3n1C)cn2CCN1CCN(C)CC1.[K+].[OH-]
• InChI: InChI=1S/C24H30N6O2.C23H28N6O2.C5H12N2.CH4O.K.H2O/c1-27-8-10-29(11-9-27)12-13-30-16-18(19-14-17-6-5-7-25-23(17)28(19)2)22-20(30)15-21(31-3)24(26-22)32-4;1-27-7-9-28(10-8-27)11-12-29-15-17(18-13-16-5-4-6-24-22(16)25-18)21-19(29)14-20(30-2)23(26-21)31-3;1-7-4-2-6-3-5-7;1-2;;/h5-7,14-16H,8-13H2,1-4H3;4-6,13-15H,7-12H2,1-3H3,(H,24,25);6H,2-5H2,1H3;2H,1H3;;1H2/q;;;;+1;/p-1
• InChIKey: QXQNEPJZZVJDRO-UHFFFAOYSA-M
• XLogP: 1.66
• TPSA: 197.52 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 19
• Rotatable Bonds: 12
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1043.37
LogP ≤ 5	1.66
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide?

The IUPAC name of potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide (CID 160547721) is potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide.

What is the SMILES notation for potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide?

The canonical SMILES for potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide is CN1CCNCC1.CO.COc1cc2c(nc1OC)c(-c1cc3cccnc3[nH]1)cn2CCN1CCN(C)CC1.COc1cc2c(nc1OC)c(-c1cc3cccnc3n1C)cn2CCN1CCN(C)CC1.[K+].[OH-].

What is the InChIKey of potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide?

The InChIKey is QXQNEPJZZVJDRO-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H30N6O2.C23H28N6O2.C5H12N2.CH4O.K.H2O/c1-27-8-10-29(11-9-27)12-13-30-16-18(19-14-17-6-5-7-25-23(17)28(19)2)22-20(30)15-21(31-3)24(26-22)32-4;1-27-7-9-28(10-8-27)11-12-29-15-17(18-13-16-5-4-6-24-22(16)25-18)21-19(29)14-20(30-2)23(26-21)31-3;1-7-4-2-6-3-5-7;1-2;;/h5-7,14-16H,8-13H2,1-4H3;4-6,13-15H,7-12H2,1-3H3,(H,24,25);6H,2-5H2,1H3;2H,1H3;;1H2/q;;;;+1;/p-1.

What are the key properties of potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide?

potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide has a molecular weight of 1043.37 g/mol, XLogP of 1.66, 12 rotatable bonds, 3 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1-methylpyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;5,6-dimethoxy-1-[2-(4-methylpiperazin-1-yl)ethyl]-3-(1H-pyrrolo[2,3-b]pyridin-2-yl)pyrrolo[3,2-b]pyridine;methanol;1-methylpiperazine;hydroxide is sourced from PubChem (CID 160547721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).