6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine

C137H145BBr5N35O9 — CID 165059586

About 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine

6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine (PubChem CID 165059586) has the molecular formula C137H145BBr5N35O9 and a molecular weight of 2836.23 g/mol. Its IUPAC name is 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine.

Molecular Properties

• Compound Name: 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine
• PubChem CID: 165059586
• Molecular Formula: C137H145BBr5N35O9
• Molecular Weight: 2836.23 g/mol
• Exact Mass: 2829.80
• IUPAC Name: 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine
• SMILES: Brc1ccc(N2CCNCC2)nc1.COc1ccc(CN2CCN(c3ccc(-c4cc(Br)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(-c4cc(C5=CCOCC5)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(-c4cc(C5=CCOCC5)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(B4OC(C)(C)C(C)(C)O4)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(Br)cn3)CC2)cn1.N#Cc1cnn2cc(Br)cc(Br)c12
• InChI: InChI=1S/2C29H29N7O2.C24H22BrN7O.C22H31BN4O3.C16H19BrN4O.C9H12BrN3.C8H3Br2N3/c2*1-37-28-5-2-21(16-32-28)19-34-8-10-35(11-9-34)27-4-3-23(17-31-27)26-14-24(22-6-12-38-13-7-22)20-36-29(26)25(15-30)18-33-36;1-33-23-5-2-17(12-28-23)15-30-6-8-31(9-7-30)22-4-3-18(13-27-22)21-10-20(25)16-32-24(21)19(11-26)14-29-32;1-21(2)22(3,4)30-23(29-21)18-7-8-19(24-15-18)27-12-10-26(11-13-27)16-17-6-9-20(28-5)25-14-17;1-22-16-5-2-13(10-19-16)12-20-6-8-21(9-7-20)15-4-3-14(17)11-18-15;10-8-1-2-9(12-7-8)13-5-3-11-4-6-13;9-6-1-7(10)8-5(2-11)3-12-13(8)4-6/h2*2-6,14,16-18,20H,7-13,19H2,1H3;2-5,10,12-14,16H,6-9,15H2,1H3;6-9,14-15H,10-13,16H2,1-5H3;2-5,10-11H,6-9,12H2,1H3;1-2,7,11H,3-6H2;1,3-4H
• InChIKey: QZCJFUAPKJKOFA-UHFFFAOYSA-N
• XLogP: 20.01
• TPSA: 436.89 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 44
• Rotatable Bonds: 27
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2836.23
LogP ≤ 5	20.01
H-Bond Donors ≤ 5	1
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 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine?

The IUPAC name of 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine (CID 165059586) is 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine.

What is the SMILES notation for 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine?

The canonical SMILES for 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine is Brc1ccc(N2CCNCC2)nc1.COc1ccc(CN2CCN(c3ccc(-c4cc(Br)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(-c4cc(C5=CCOCC5)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(-c4cc(C5=CCOCC5)cn5ncc(C#N)c45)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(B4OC(C)(C)C(C)(C)O4)cn3)CC2)cn1.COc1ccc(CN2CCN(c3ccc(Br)cn3)CC2)cn1.N#Cc1cnn2cc(Br)cc(Br)c12.

What is the InChIKey of 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine?

The InChIKey is QZCJFUAPKJKOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C29H29N7O2.C24H22BrN7O.C22H31BN4O3.C16H19BrN4O.C9H12BrN3.C8H3Br2N3/c2*1-37-28-5-2-21(16-32-28)19-34-8-10-35(11-9-34)27-4-3-23(17-31-27)26-14-24(22-6-12-38-13-7-22)20-36-29(26)25(15-30)18-33-36;1-33-23-5-2-17(12-28-23)15-30-6-8-31(9-7-30)22-4-3-18(13-27-22)21-10-20(25)16-32-24(21)19(11-26)14-29-32;1-21(2)22(3,4)30-23(29-21)18-7-8-19(24-15-18)27-12-10-26(11-13-27)16-17-6-9-20(28-5)25-14-17;1-22-16-5-2-13(10-19-16)12-20-6-8-21(9-7-20)15-4-3-14(17)11-18-15;10-8-1-2-9(12-7-8)13-5-3-11-4-6-13;9-6-1-7(10)8-5(2-11)3-12-13(8)4-6/h2*2-6,14,16-18,20H,7-13,19H2,1H3;2-5,10,12-14,16H,6-9,15H2,1H3;6-9,14-15H,10-13,16H2,1-5H3;2-5,10-11H,6-9,12H2,1H3;1-2,7,11H,3-6H2;1,3-4H.

What are the key properties of 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine?

6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine has a molecular weight of 2836.23 g/mol, XLogP of 20.01, 27 rotatable bonds, 1 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;1-(5-bromo-2-pyridinyl)-4-[(6-methoxy-3-pyridinyl)methyl]piperazine;1-(5-bromo-2-pyridinyl)piperazine;4,6-dibromopyrazolo[1,5-a]pyridine-3-carbonitrile;bis(6-(3,6-dihydro-2H-pyran-4-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile);1-[(6-methoxy-3-pyridinyl)methyl]-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine is sourced from PubChem (CID 165059586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).