6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one

C17H13N5O2 — CID 135692487

IUPAC6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one
SMILESO=c1[nH]c(O)c(/N=N/c2ccccc2)cc1/N=N/c1ccccc1
InChIInChI=1S/C17H13N5O2/c23-16-14(21-19-12-7-3-1-4-8-12)11-15(17(24)18-16)22-20-13-9-5-2-6-10-13/h1-11H,(H2,18,23,24)/b21-19+,22-20+
InChIKeyIDJMEINYLPQVJO-FLFKKZLDSA-N
MW319.32 g/mol
LogP4.91
Rot. Bonds4

About 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one

6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one (PubChem CID 135692487) has the molecular formula C17H13N5O2 and a molecular weight of 319.32 g/mol. Its IUPAC name is 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one
PubChem CID135692487
Molecular FormulaC17H13N5O2
Molecular Weight319.32 g/mol
Exact Mass319.11
IUPAC Name6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one
SMILESO=c1[nH]c(O)c(/N=N/c2ccccc2)cc1/N=N/c1ccccc1
InChIInChI=1S/C17H13N5O2/c23-16-14(21-19-12-7-3-1-4-8-12)11-15(17(24)18-16)22-20-13-9-5-2-6-10-13/h1-11H,(H2,18,23,24)/b21-19+,22-20+
InChIKeyIDJMEINYLPQVJO-FLFKKZLDSA-N
XLogP4.91
TPSA102.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.32
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one?
The IUPAC name of 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one (CID 135692487) is 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one?
The canonical SMILES for 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one is O=c1[nH]c(O)c(/N=N/c2ccccc2)cc1/N=N/c1ccccc1.
What is the InChIKey of 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one?
The InChIKey is IDJMEINYLPQVJO-FLFKKZLDSA-N. The full InChI is InChI=1S/C17H13N5O2/c23-16-14(21-19-12-7-3-1-4-8-12)11-15(17(24)18-16)22-20-13-9-5-2-6-10-13/h1-11H,(H2,18,23,24)/b21-19+,22-20+.
What are the key properties of 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one?
6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one has a molecular weight of 319.32 g/mol, XLogP of 4.91, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-3,5-bis(phenyldiazenyl)-1H-pyridin-2-one is sourced from PubChem (CID 135692487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).