4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine

C26H26N8O — CID 167366502

About 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine

4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine (PubChem CID 167366502) has the molecular formula C26H26N8O and a molecular weight of 466.55 g/mol. Its IUPAC name is 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine.

Molecular Properties

• Compound Name: 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine
• PubChem CID: 167366502
• Molecular Formula: C26H26N8O
• Molecular Weight: 466.55 g/mol
• Exact Mass: 466.22
• IUPAC Name: 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine
• SMILES: Cc1cccc(-c2[nH]ncc2-c2ccc3nccc(-c4cnn(CCN5CCOCC5)c4)c3n2)n1
• InChI: InChI=1S/C26H26N8O/c1-18-3-2-4-24(30-18)26-21(16-28-32-26)22-5-6-23-25(31-22)20(7-8-27-23)19-15-29-34(17-19)10-9-33-11-13-35-14-12-33/h2-8,15-17H,9-14H2,1H3,(H,28,32)
• InChIKey: CKBDXQCMXSLDFY-UHFFFAOYSA-N
• XLogP: 3.59
• TPSA: 97.64 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	466.55
LogP ≤ 5	3.59
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine?

The IUPAC name of 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine (CID 167366502) is 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine.

What is the SMILES notation for 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine?

The canonical SMILES for 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine is Cc1cccc(-c2[nH]ncc2-c2ccc3nccc(-c4cnn(CCN5CCOCC5)c4)c3n2)n1.

What is the InChIKey of 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine?

The InChIKey is CKBDXQCMXSLDFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N8O/c1-18-3-2-4-24(30-18)26-21(16-28-32-26)22-5-6-23-25(31-22)20(7-8-27-23)19-15-29-34(17-19)10-9-33-11-13-35-14-12-33/h2-8,15-17H,9-14H2,1H3,(H,28,32).

What are the key properties of 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine?

4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine has a molecular weight of 466.55 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine is sourced from PubChem (CID 167366502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).