2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride

C119H167BCl8N32O14S — CID 159683107

About 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride

2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride (PubChem CID 159683107) has the molecular formula C119H167BCl8N32O14S and a molecular weight of 2596.36 g/mol. Its IUPAC name is 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride.

Molecular Properties

• Compound Name: 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride
• PubChem CID: 159683107
• Molecular Formula: C119H167BCl8N32O14S
• Molecular Weight: 2596.36 g/mol
• Exact Mass: 2591.07
• IUPAC Name: 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride
• SMILES: C.CC1=NCc2ncc(-c3cncc(OCCN4CCN(C)CC4)n3)cc21.CN1CCC(C(=O)Cc2cncc(Cl)n2)CC1.CN1CCC(C(=O)O)CC1.CN1CCC(C(=O)O)CC1.CN1CCN(CCO)CC1.CN1CCN(CCOc2cncc(Cl)n2)CC1.COc1ccc(Cn2nc(C)c3cc(-c4cncc(OCCN5CCN(C)CC5)n4)cnc32)cc1.COc1ccc(Cn2nc(C)c3cc(B4OC(C)(C)C(C)(C)O4)cnc32)cc1.Cl.Clc1cncc(Cl)n1.Nc1cncc(Cl)n1.O=S(Cl)Cl
• InChI: InChI=1S/C26H31N7O2.C21H26BN3O3.C19H24N6O.C12H16ClN3O.C11H17ClN4O.C7H16N2O.2C7H13NO2.C4H2Cl2N2.C4H4ClN3.CH4.Cl2OS.ClH/c1-19-23-14-21(15-28-26(23)33(30-19)18-20-4-6-22(34-3)7-5-20)24-16-27-17-25(29-24)35-13-12-32-10-8-31(2)9-11-32;1-14-18-11-16(22-27-20(2,3)21(4,5)28-22)12-23-19(18)25(24-14)13-15-7-9-17(26-6)10-8-15;1-14-16-9-15(10-22-18(16)12-21-14)17-11-20-13-19(23-17)26-8-7-25-5-3-24(2)4-6-25;1-16-4-2-9(3-5-16)11(17)6-10-7-14-8-12(13)15-10;1-15-2-4-16(5-3-15)6-7-17-11-9-13-8-10(12)14-11;1-8-2-4-9(5-3-8)6-7-10;2*1-8-4-2-6(3-5-8)7(9)10;2*5-3-1-7-2-4(6)8-3;;1-4(2)3;/h4-7,14-17H,8-13,18H2,1-3H3;7-12H,13H2,1-6H3;9-11,13H,3-8,12H2,1-2H3;7-9H,2-6H2,1H3;8-9H,2-7H2,1H3;10H,2-7H2,1H3;2*6H,2-5H2,1H3,(H,9,10);1-2H;1-2H,(H2,6,8);1H4;;1H
• InChIKey: OVENFBHJBBCTHE-UHFFFAOYSA-N
• XLogP: 14.45
• TPSA: 496.59 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 44
• Rotatable Bonds: 28
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2596.36
LogP ≤ 5	14.45
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	44

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride?

The IUPAC name of 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride (CID 159683107) is 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride.

What is the SMILES notation for 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride?

The canonical SMILES for 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride is C.CC1=NCc2ncc(-c3cncc(OCCN4CCN(C)CC4)n3)cc21.CN1CCC(C(=O)Cc2cncc(Cl)n2)CC1.CN1CCC(C(=O)O)CC1.CN1CCC(C(=O)O)CC1.CN1CCN(CCO)CC1.CN1CCN(CCOc2cncc(Cl)n2)CC1.COc1ccc(Cn2nc(C)c3cc(-c4cncc(OCCN5CCN(C)CC5)n4)cnc32)cc1.COc1ccc(Cn2nc(C)c3cc(B4OC(C)(C)C(C)(C)O4)cnc32)cc1.Cl.Clc1cncc(Cl)n1.Nc1cncc(Cl)n1.O=S(Cl)Cl.

What is the InChIKey of 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride?

The InChIKey is OVENFBHJBBCTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31N7O2.C21H26BN3O3.C19H24N6O.C12H16ClN3O.C11H17ClN4O.C7H16N2O.2C7H13NO2.C4H2Cl2N2.C4H4ClN3.CH4.Cl2OS.ClH/c1-19-23-14-21(15-28-26(23)33(30-19)18-20-4-6-22(34-3)7-5-20)24-16-27-17-25(29-24)35-13-12-32-10-8-31(2)9-11-32;1-14-18-11-16(22-27-20(2,3)21(4,5)28-22)12-23-19(18)25(24-14)13-15-7-9-17(26-6)10-8-15;1-14-16-9-15(10-22-18(16)12-21-14)17-11-20-13-19(23-17)26-8-7-25-5-3-24(2)4-6-25;1-16-4-2-9(3-5-16)11(17)6-10-7-14-8-12(13)15-10;1-15-2-4-16(5-3-15)6-7-17-11-9-13-8-10(12)14-11;1-8-2-4-9(5-3-8)6-7-10;2*1-8-4-2-6(3-5-8)7(9)10;2*5-3-1-7-2-4(6)8-3;;1-4(2)3;/h4-7,14-17H,8-13,18H2,1-3H3;7-12H,13H2,1-6H3;9-11,13H,3-8,12H2,1-2H3;7-9H,2-6H2,1H3;8-9H,2-7H2,1H3;10H,2-7H2,1H3;2*6H,2-5H2,1H3,(H,9,10);1-2H;1-2H,(H2,6,8);1H4;;1H.

What are the key properties of 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride?

2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride has a molecular weight of 2596.36 g/mol, XLogP of 14.45, 28 rotatable bonds, 4 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazine;6-chloropyrazin-2-amine;2-(6-chloropyrazin-2-yl)-1-(1-methylpiperidin-4-yl)ethanone;2,6-dichloropyrazine;methane;1-[(4-methoxyphenyl)methyl]-3-methyl-5-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]pyrazolo[5,4-b]pyridine;1-[(4-methoxyphenyl)methyl]-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazolo[5,4-b]pyridine;5-methyl-3-[6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrazin-2-yl]-7H-pyrrolo[3,4-b]pyridine;2-(4-methylpiperazin-1-yl)ethanol;bis(1-methylpiperidine-4-carboxylic acid);thionyl dichloride;hydrochloride is sourced from PubChem (CID 159683107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).