7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine

C94H79BrIN25O2 — CID 158237498

About 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine

7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine (PubChem CID 158237498) has the molecular formula C94H79BrIN25O2 and a molecular weight of 1797.65 g/mol. Its IUPAC name is 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine.

Molecular Properties

• Compound Name: 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine
• PubChem CID: 158237498
• Molecular Formula: C94H79BrIN25O2
• Molecular Weight: 1797.65 g/mol
• Exact Mass: 1795.51
• IUPAC Name: 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine
• SMILES: Cc1cccc(-c2[nH]nc(NCCN3CCOCC3)c2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2n[nH]c(I)c2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2nn(C3CCCCO3)cc2-c2ccc3ncc(Br)cc3n2)n1
• InChI: InChI=1S/C28H28N8O.C22H20BrN5O.C22H15IN6.C22H16N6/c1-19-3-2-4-24(32-19)27-26(28(35-34-27)30-11-12-36-13-15-37-16-14-36)23-6-5-22-25(33-23)17-21(18-31-22)20-7-9-29-10-8-20;1-14-5-4-6-19(25-14)22-16(13-28(27-22)21-7-2-3-10-29-21)17-8-9-18-20(26-17)11-15(23)12-24-18;1-13-3-2-4-18(26-13)21-20(22(23)29-28-21)17-6-5-16-19(27-17)11-15(12-25-16)14-7-9-24-10-8-14;1-14-3-2-4-20(26-14)22-17(13-25-28-22)18-5-6-19-21(27-18)11-16(12-24-19)15-7-9-23-10-8-15/h2-10,17-18H,11-16H2,1H3,(H2,30,34,35);4-6,8-9,11-13,21H,2-3,7,10H2,1H3;2-12H,1H3,(H,28,29);2-13H,1H3,(H,25,28)
• InChIKey: GFDKHUVBGGBIQX-UHFFFAOYSA-N
• XLogP: 19.03
• TPSA: 330.94 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 24
• Rotatable Bonds: 16
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1797.65
LogP ≤ 5	19.03
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine?

The IUPAC name of 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine (CID 158237498) is 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine.

What is the SMILES notation for 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine?

The canonical SMILES for 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine is Cc1cccc(-c2[nH]nc(NCCN3CCOCC3)c2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2n[nH]c(I)c2-c2ccc3ncc(-c4ccncc4)cc3n2)n1.Cc1cccc(-c2nn(C3CCCCO3)cc2-c2ccc3ncc(Br)cc3n2)n1.

What is the InChIKey of 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine?

The InChIKey is GFDKHUVBGGBIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N8O.C22H20BrN5O.C22H15IN6.C22H16N6/c1-19-3-2-4-24(32-19)27-26(28(35-34-27)30-11-12-36-13-15-37-16-14-36)23-6-5-22-25(33-23)17-21(18-31-22)20-7-9-29-10-8-20;1-14-5-4-6-19(25-14)22-16(13-28(27-22)21-7-2-3-10-29-21)17-8-9-18-20(26-17)11-15(23)12-24-18;1-13-3-2-4-18(26-13)21-20(22(23)29-28-21)17-6-5-16-19(27-17)11-15(12-25-16)14-7-9-24-10-8-14;1-14-3-2-4-20(26-14)22-17(13-25-28-22)18-5-6-19-21(27-18)11-16(12-24-19)15-7-9-23-10-8-15/h2-10,17-18H,11-16H2,1H3,(H2,30,34,35);4-6,8-9,11-13,21H,2-3,7,10H2,1H3;2-12H,1H3,(H,28,29);2-13H,1H3,(H,25,28).

What are the key properties of 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine?

7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine has a molecular weight of 1797.65 g/mol, XLogP of 19.03, 16 rotatable bonds, 4 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-[3-(6-methyl-2-pyridinyl)-1-(oxan-2-yl)pyrazol-4-yl]-1,5-naphthyridine;2-[5-iodo-3-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine;5-(6-methyl-2-pyridinyl)-N-(2-morpholin-4-ylethyl)-4-(7-pyridin-4-yl-1,5-naphthyridin-2-yl)-1H-pyrazol-3-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-pyridin-4-yl-1,5-naphthyridine is sourced from PubChem (CID 158237498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).