2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol

C14H15N3O2 — CID 3384370

IUPAC2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
SMILESCCOc1cc(C=NNc2ccccn2)ccc1O
InChIInChI=1S/C14H15N3O2/c1-2-19-13-9-11(6-7-12(13)18)10-16-17-14-5-3-4-8-15-14/h3-10,18H,2H2,1H3,(H,15,17)
InChIKeyGPZOIUSDGSYHNC-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.63
Rot. Bonds5

About 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol

2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol (PubChem CID 3384370) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol.

Molecular Properties

Compound Name2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
PubChem CID3384370
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
SMILESCCOc1cc(C=NNc2ccccn2)ccc1O
InChIInChI=1S/C14H15N3O2/c1-2-19-13-9-11(6-7-12(13)18)10-16-17-14-5-3-4-8-15-14/h3-10,18H,2H2,1H3,(H,15,17)
InChIKeyGPZOIUSDGSYHNC-UHFFFAOYSA-N
XLogP2.63
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.63
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 3709889
N-[(3-ethoxy-4-propoxyphenyl)methylideneamino]pyridin-2-amine
CID 84932002
N-[(Z)-[3-ethoxy-4-(2-methylpropoxy)phenyl]methylideneamino]pyridin-2-amine
CID 9121639
4-[(Z)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-ethoxyphenol
CID 136806309
4-[(E)-[(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]methyl]-2-ethoxyphenol
CID 135620435
4-[(E)-[(4-chlorophenyl)hydrazinylidene]methyl]-2-ethoxyphenol
CID 135675775
2-ethoxy-4-[[(2,3,4,5,6-pentafluorophenyl)hydrazinylidene]methyl]phenol
CID 4012909
4-bromo-2-ethoxy-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 135904945
4-[(E)-[(3-chlorophenyl)hydrazinylidene]methyl]-2-ethoxyphenol
CID 135576630
2-ethoxy-4-[[[3-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenol
CID 136704774
2-ethoxy-4-[(E)-[(2,3,5,6-tetrafluorophenyl)hydrazinylidene]methyl]phenol
CID 135613721
2-ethoxy-4-[[(4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenol
CID 2845141

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol?
The IUPAC name of 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol (CID 3384370) is 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol.
What is the SMILES notation for 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol?
The canonical SMILES for 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol is CCOc1cc(C=NNc2ccccn2)ccc1O.
What is the InChIKey of 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol?
The InChIKey is GPZOIUSDGSYHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-2-19-13-9-11(6-7-12(13)18)10-16-17-14-5-3-4-8-15-14/h3-10,18H,2H2,1H3,(H,15,17).
What are the key properties of 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol?
2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol has a molecular weight of 257.29 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-[(pyridin-2-ylhydrazinylidene)methyl]phenol is sourced from PubChem (CID 3384370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).