2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine

C23H29FN8 — CID 59438241

About 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine

2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine (PubChem CID 59438241) has the molecular formula C23H29FN8 and a molecular weight of 436.54 g/mol. Its IUPAC name is 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine.

Molecular Properties

• Compound Name: 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine
• PubChem CID: 59438241
• Molecular Formula: C23H29FN8
• Molecular Weight: 436.54 g/mol
• Exact Mass: 436.25
• IUPAC Name: 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine
• SMILES: Cc1c(CN2CCN(c3nccnc3N3CCC(F)CC3)CC2)cnn1-c1ccccn1
• InChI: InChI=1S/C23H29FN8/c1-18-19(16-28-32(18)21-4-2-3-7-25-21)17-29-12-14-31(15-13-29)23-22(26-8-9-27-23)30-10-5-20(24)6-11-30/h2-4,7-9,16,20H,5-6,10-15,17H2,1H3
• InChIKey: UFTRYTOMBYHSIN-UHFFFAOYSA-N
• XLogP: 2.63
• TPSA: 66.21 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.54
LogP ≤ 5	2.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine?

The IUPAC name of 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine (CID 59438241) is 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine.

What is the SMILES notation for 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine?

The canonical SMILES for 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine is Cc1c(CN2CCN(c3nccnc3N3CCC(F)CC3)CC2)cnn1-c1ccccn1.

What is the InChIKey of 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine?

The InChIKey is UFTRYTOMBYHSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29FN8/c1-18-19(16-28-32(18)21-4-2-3-7-25-21)17-29-12-14-31(15-13-29)23-22(26-8-9-27-23)30-10-5-20(24)6-11-30/h2-4,7-9,16,20H,5-6,10-15,17H2,1H3.

What are the key properties of 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine?

2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine has a molecular weight of 436.54 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-fluoropiperidin-1-yl)-3-[4-[(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine is sourced from PubChem (CID 59438241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).