(1-hydroxy-4-pyridinylidene)methyl-methyldiazene

C7H9N3O — CID 90481834

IUPAC(1-hydroxy-4-pyridinylidene)methyl-methyldiazene
SMILESC/N=N/C=C1C=CN(O)C=C1
InChIInChI=1S/C7H9N3O/c1-8-9-6-7-2-4-10(11)5-3-7/h2-6,11H,1H3/b9-8+
InChIKeyBYSVKNSXNNZFDF-CMDGGOBGSA-N
MW151.17 g/mol
LogP1.68
Rot. Bonds1

About (1-hydroxy-4-pyridinylidene)methyl-methyldiazene

(1-hydroxy-4-pyridinylidene)methyl-methyldiazene (PubChem CID 90481834) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is (1-hydroxy-4-pyridinylidene)methyl-methyldiazene.

Molecular Properties

Compound Name(1-hydroxy-4-pyridinylidene)methyl-methyldiazene
PubChem CID90481834
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name(1-hydroxy-4-pyridinylidene)methyl-methyldiazene
SMILESC/N=N/C=C1C=CN(O)C=C1
InChIInChI=1S/C7H9N3O/c1-8-9-6-7-2-4-10(11)5-3-7/h2-6,11H,1H3/b9-8+
InChIKeyBYSVKNSXNNZFDF-CMDGGOBGSA-N
XLogP1.68
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-hydroxy-4-pyridinylidene)methyl-methyldiazene?
The IUPAC name of (1-hydroxy-4-pyridinylidene)methyl-methyldiazene (CID 90481834) is (1-hydroxy-4-pyridinylidene)methyl-methyldiazene.
What is the SMILES notation for (1-hydroxy-4-pyridinylidene)methyl-methyldiazene?
The canonical SMILES for (1-hydroxy-4-pyridinylidene)methyl-methyldiazene is C/N=N/C=C1C=CN(O)C=C1.
What is the InChIKey of (1-hydroxy-4-pyridinylidene)methyl-methyldiazene?
The InChIKey is BYSVKNSXNNZFDF-CMDGGOBGSA-N. The full InChI is InChI=1S/C7H9N3O/c1-8-9-6-7-2-4-10(11)5-3-7/h2-6,11H,1H3/b9-8+.
What are the key properties of (1-hydroxy-4-pyridinylidene)methyl-methyldiazene?
(1-hydroxy-4-pyridinylidene)methyl-methyldiazene has a molecular weight of 151.17 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxy-4-pyridinylidene)methyl-methyldiazene is sourced from PubChem (CID 90481834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).