4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol

C10H11N3O2 — CID 135721698

IUPAC4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol
SMILESCC(/C=N/O)=N/N=C/c1ccc(O)cc1
InChIInChI=1S/C10H11N3O2/c1-8(6-12-15)13-11-7-9-2-4-10(14)5-3-9/h2-7,14-15H,1H3/b11-7+,12-6+,13-8-
InChIKeyHZEZWPNVFINYSY-RYMVUWDUSA-N
MW205.22 g/mol
LogP1.65
Rot. Bonds3

About 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol

4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol (PubChem CID 135721698) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol.

Molecular Properties

Compound Name4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol
PubChem CID135721698
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol
SMILESCC(/C=N/O)=N/N=C/c1ccc(O)cc1
InChIInChI=1S/C10H11N3O2/c1-8(6-12-15)13-11-7-9-2-4-10(14)5-3-9/h2-7,14-15H,1H3/b11-7+,12-6+,13-8-
InChIKeyHZEZWPNVFINYSY-RYMVUWDUSA-N
XLogP1.65
TPSA77.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(NZ)-N-[(3Z)-2-[(E)-benzylidenehydrazinylidene]-3-hydroxyiminopropylidene]hydroxylamine
CID 136815583
4-[[(4-fluorophenyl)methylidenehydrazinylidene]methyl]phenol
CID 136628037
methyl (NE,1Z)-N-[(4-hydroxyphenyl)methylidene]-2-methylsulfanylethanehydrazonate
CID 142831004
4-[[2-[(4-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol
CID 135633900
N'-[(E)-(4-hydroxyphenyl)methylideneamino]pyridine-2-carboximidamide
CID 170856108
(Z)-N-[(Z)-benzylideneamino]-1-(triphenyl-λ5-phosphanylidene)propan-2-imine
CID 134876722
4-amino-N'-[(4-hydroxyphenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
CID 2841390
4-[(E)-(fluoren-9-ylidenehydrazinylidene)methyl]phenol
CID 135559008
1-N',2-N'-bis[(Z)-(4-methylphenyl)methylideneamino]ethanediimidamide
CID 171376890
4-[(E)-[methyl(phosphanyl)hydrazinylidene]methyl]phenol
CID 138483443
(E)-N-[(E)-benzylideneamino]-1-phenylethanimine
CID 177482711
4-hydroxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]benzamide;methanol
CID 139076899

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol?
The IUPAC name of 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol (CID 135721698) is 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol.
What is the SMILES notation for 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol?
The canonical SMILES for 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol is CC(/C=N/O)=N/N=C/c1ccc(O)cc1.
What is the InChIKey of 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol?
The InChIKey is HZEZWPNVFINYSY-RYMVUWDUSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-8(6-12-15)13-11-7-9-2-4-10(14)5-3-9/h2-7,14-15H,1H3/b11-7+,12-6+,13-8-.
What are the key properties of 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol?
4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol has a molecular weight of 205.22 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-[(Z)-[(1E)-1-hydroxyiminopropan-2-ylidene]hydrazinylidene]methyl]phenol is sourced from PubChem (CID 135721698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).