2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol

C12H11N3O — CID 135400279

IUPAC2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol
SMILESOc1ccccc1/C=N\Nc1ccccn1
InChIInChI=1S/C12H11N3O/c16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12/h1-9,16H,(H,13,15)/b14-9-
InChIKeyVZOPTEASQLBLJX-ZROIWOOFSA-N
MW213.24 g/mol
LogP2.23
Rot. Bonds3

About 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol

2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol (PubChem CID 135400279) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol.

Molecular Properties

Compound Name2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol
PubChem CID135400279
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol
SMILESOc1ccccc1/C=N\Nc1ccccn1
InChIInChI=1S/C12H11N3O/c16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12/h1-9,16H,(H,13,15)/b14-9-
InChIKeyVZOPTEASQLBLJX-ZROIWOOFSA-N
XLogP2.23
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The IUPAC name of 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol (CID 135400279) is 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol.
What is the SMILES notation for 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The canonical SMILES for 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol is Oc1ccccc1/C=N\Nc1ccccn1.
What is the InChIKey of 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The InChIKey is VZOPTEASQLBLJX-ZROIWOOFSA-N. The full InChI is InChI=1S/C12H11N3O/c16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12/h1-9,16H,(H,13,15)/b14-9-.
What are the key properties of 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol has a molecular weight of 213.24 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(pyridin-2-ylhydrazinylidene)methyl]phenol is sourced from PubChem (CID 135400279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).