2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide

C125H80N40O10 — CID 158140466

About 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide

2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide (PubChem CID 158140466) has the molecular formula C125H80N40O10 and a molecular weight of 2302.28 g/mol. Its IUPAC name is 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide.

Molecular Properties

• Compound Name: 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide
• PubChem CID: 158140466
• Molecular Formula: C125H80N40O10
• Molecular Weight: 2302.28 g/mol
• Exact Mass: 2300.70
• IUPAC Name: 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide
• SMILES: [C-]#[N+]c1cnn(-c2ccccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ccncn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2cnccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ncccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ncncn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O
• InChI: InChI=1S/C26H17N7O2.3C25H16N8O2.C24H15N9O2/c1-27-21-16-29-33(22-13-7-8-14-28-22)25(21)32-31-20-15-17-9-5-6-12-19(17)23(24(20)34)26(35)30-18-10-3-2-4-11-18;1-26-20-15-29-33(25-27-12-7-13-28-25)23(20)32-31-19-14-16-8-5-6-11-18(16)21(22(19)34)24(35)30-17-9-3-2-4-10-17;1-26-20-14-29-33(21-15-27-11-12-28-21)24(20)32-31-19-13-16-7-5-6-10-18(16)22(23(19)34)25(35)30-17-8-3-2-4-9-17;1-26-20-14-29-33(21-11-12-27-15-28-21)24(20)32-31-19-13-16-7-5-6-10-18(16)22(23(19)34)25(35)30-17-8-3-2-4-9-17;1-25-19-12-29-33(24-27-13-26-14-28-24)22(19)32-31-18-11-15-7-5-6-10-17(15)20(21(18)34)23(35)30-16-8-3-2-4-9-16/h2-16,34H,(H,30,35);3*2-15,34H,(H,30,35);2-14,34H,(H,30,35)/b5*32-31+
• InChIKey: FTWJDKWRQXWMDO-UVVQSVPZSA-N
• XLogP: 28.70
• TPSA: 610.05 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 40
• Rotatable Bonds: 25
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2302.28
LogP ≤ 5	28.70
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide?

The IUPAC name of 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide (CID 158140466) is 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide.

What is the SMILES notation for 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide?

The canonical SMILES for 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide is [C-]#[N+]c1cnn(-c2ccccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ccncn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2cnccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ncccn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.[C-]#[N+]c1cnn(-c2ncncn2)c1/N=N/c1cc2ccccc2c(C(=O)Nc2ccccc2)c1O.

What is the InChIKey of 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide?

The InChIKey is FTWJDKWRQXWMDO-UVVQSVPZSA-N. The full InChI is InChI=1S/C26H17N7O2.3C25H16N8O2.C24H15N9O2/c1-27-21-16-29-33(22-13-7-8-14-28-22)25(21)32-31-20-15-17-9-5-6-12-19(17)23(24(20)34)26(35)30-18-10-3-2-4-11-18;1-26-20-15-29-33(25-27-12-7-13-28-25)23(20)32-31-19-14-16-8-5-6-11-18(16)21(22(19)34)24(35)30-17-9-3-2-4-10-17;1-26-20-14-29-33(21-15-27-11-12-28-21)24(20)32-31-19-13-16-7-5-6-10-18(16)22(23(19)34)25(35)30-17-8-3-2-4-9-17;1-26-20-14-29-33(21-11-12-27-15-28-21)24(20)32-31-19-13-16-7-5-6-10-18(16)22(23(19)34)25(35)30-17-8-3-2-4-9-17;1-25-19-12-29-33(24-27-13-26-14-28-24)22(19)32-31-18-11-15-7-5-6-10-17(15)20(21(18)34)23(35)30-16-8-3-2-4-9-16/h2-16,34H,(H,30,35);3*2-15,34H,(H,30,35);2-14,34H,(H,30,35)/b5*32-31+.

What are the key properties of 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide?

2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide has a molecular weight of 2302.28 g/mol, XLogP of 28.70, 25 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2-hydroxy-3-[(4-isocyano-1-pyrazin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyridin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-2-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[(4-isocyano-1-pyrimidin-4-ylpyrazol-5-yl)diazenyl]-N-phenylnaphthalene-1-carboxamide;2-hydroxy-3-[[4-isocyano-1-(1,3,5-triazin-2-yl)pyrazol-5-yl]diazenyl]-N-phenylnaphthalene-1-carboxamide is sourced from PubChem (CID 158140466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).