6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C26H26N10 — CID 126740454

About 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 126740454) has the molecular formula C26H26N10 and a molecular weight of 478.56 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

• Compound Name: 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
• PubChem CID: 126740454
• Molecular Formula: C26H26N10
• Molecular Weight: 478.56 g/mol
• Exact Mass: 478.23
• IUPAC Name: 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
• SMILES: Cn1cc(-c2cc(-c3ccc(N4CCN(Cc5ccn(C)n5)CC4)nc3)c3c(C#N)cnn3c2)cn1
• InChI: InChI=1S/C26H26N10/c1-32-6-5-23(31-32)18-34-7-9-35(10-8-34)25-4-3-19(13-28-25)24-11-20(22-15-29-33(2)16-22)17-36-26(24)21(12-27)14-30-36/h3-6,11,13-17H,7-10,18H2,1-2H3
• InChIKey: CBPRJDOOVLIUDH-UHFFFAOYSA-N
• XLogP: 2.72
• TPSA: 96.10 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 5
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	478.56
LogP ≤ 5	2.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The IUPAC name of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 126740454) is 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The canonical SMILES for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is Cn1cc(-c2cc(-c3ccc(N4CCN(Cc5ccn(C)n5)CC4)nc3)c3c(C#N)cnn3c2)cn1.

What is the InChIKey of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

The InChIKey is CBPRJDOOVLIUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N10/c1-32-6-5-23(31-32)18-34-7-9-35(10-8-34)25-4-3-19(13-28-25)24-11-20(22-15-29-33(2)16-22)17-36-26(24)21(12-27)14-30-36/h3-6,11,13-17H,7-10,18H2,1-2H3.

What are the key properties of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?

6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 478.56 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-3-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 126740454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).