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

C12H11N3O — CID 135439965

IUPAC2-[(E)-(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-NTEUORMPSA-N
MW213.24 g/mol
LogP2.23
Rot. Bonds3

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

2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol (PubChem CID 135439965) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol.

Molecular Properties

Compound Name2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol
PubChem CID135439965
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name2-[(E)-(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-NTEUORMPSA-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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Related Compounds

2-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-N-pyridin-2-yl-2-sulfanylideneacetamide
CID 135938483
3-chloro-5-[(E)-(pyridin-2-ylhydrazinylidene)methyl]benzene-1,2-diol
CID 135747793
2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 2789386
2-[(Z)-[(3-chloropyrazin-2-yl)hydrazinylidene]methyl]phenol
CID 135506502
2-methoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 3709889
2,4-dinitro-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 135458967
2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 3384370
2-(pyridin-2-ylhydrazinylidene)acetic acid
CID 75030824
N-[(Z)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridin-2-amine
CID 6146230
N-[(E)-[9-[(E)-(pyridin-2-ylhydrazinylidene)methyl]-1,10-phenanthrolin-2-yl]methylideneamino]pyridin-2-amine
CID 56695626
N-[(Z)-1H-pyrrol-2-ylmethylideneamino]pyridin-2-amine
CID 136809709
N-[(3,4-dichlorophenyl)methylideneamino]pyridin-2-amine
CID 3937585

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The IUPAC name of 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol (CID 135439965) is 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol.
What is the SMILES notation for 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The canonical SMILES for 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol is Oc1ccccc1/C=N/Nc1ccccn1.
What is the InChIKey of 2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
The InChIKey is VZOPTEASQLBLJX-NTEUORMPSA-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-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol?
2-[(E)-(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-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol is sourced from PubChem (CID 135439965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).