5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol

C14H12F2N2O2 — CID 4654960

IUPAC5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol
SMILESCOc1ccc(C=NNc2ccc(F)cc2F)cc1O
InChIInChI=1S/C14H12F2N2O2/c1-20-14-5-2-9(6-13(14)19)8-17-18-12-4-3-10(15)7-11(12)16/h2-8,18-19H,1H3
InChIKeyLHAWXCVXAFDUET-UHFFFAOYSA-N
MW278.26 g/mol
LogP3.12
Rot. Bonds4

About 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol

5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol (PubChem CID 4654960) has the molecular formula C14H12F2N2O2 and a molecular weight of 278.26 g/mol. Its IUPAC name is 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol.

Molecular Properties

Compound Name5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol
PubChem CID4654960
Molecular FormulaC14H12F2N2O2
Molecular Weight278.26 g/mol
Exact Mass278.09
IUPAC Name5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol
SMILESCOc1ccc(C=NNc2ccc(F)cc2F)cc1O
InChIInChI=1S/C14H12F2N2O2/c1-20-14-5-2-9(6-13(14)19)8-17-18-12-4-3-10(15)7-11(12)16/h2-8,18-19H,1H3
InChIKeyLHAWXCVXAFDUET-UHFFFAOYSA-N
XLogP3.12
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.26
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-ethoxyphenol
CID 4288655
2-methoxy-5-[(Z)-[(2,3,4,5,6-pentafluorophenyl)hydrazinylidene]methyl]phenol
CID 9466515
5-[(Z)-[(2-chlorophenyl)hydrazinylidene]methyl]-2-methoxyphenol
CID 8002358
2-[4-[(Z)-[(2,4-difluorophenyl)hydrazinylidene]methyl]-2,6-dimethoxyphenoxy]acetamide
CID 8825944
2,6-dibromo-4-[(E)-[(2,4-difluorophenyl)hydrazinylidene]methyl]phenol
CID 135548670
2-[4-[(Z)-[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-ethoxyphenoxy]-N,N-dimethylacetamide
CID 9058353
2-methoxy-5-[[[3-(trifluoromethyl)phenyl]hydrazinylidene]methyl]phenol
CID 110841513
4-[(E)-[(2-fluorophenyl)hydrazinylidene]methyl]-2,6-dimethoxyphenol
CID 135858157
2-[(4-fluorophenyl)carbamoylamino]-N-[(Z)-(3-hydroxy-4-methoxyphenyl)methylideneamino]acetamide
CID 6027564
N-[(3-chlorophenyl)methylideneamino]-2,4-difluoroaniline
CID 5195808
4-[(E)-[(2,4-difluorophenyl)hydrazinylidene]methyl]benzene-1,3-diol
CID 135755003
N-[(E)-[3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl]methylideneamino]aniline
CID 5348595

Frequently Asked Questions

What is the IUPAC name of 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The IUPAC name of 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol (CID 4654960) is 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol.
What is the SMILES notation for 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The canonical SMILES for 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol is COc1ccc(C=NNc2ccc(F)cc2F)cc1O.
What is the InChIKey of 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
The InChIKey is LHAWXCVXAFDUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O2/c1-20-14-5-2-9(6-13(14)19)8-17-18-12-4-3-10(15)7-11(12)16/h2-8,18-19H,1H3.
What are the key properties of 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol?
5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol has a molecular weight of 278.26 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2,4-difluorophenyl)hydrazinylidene]methyl]-2-methoxyphenol is sourced from PubChem (CID 4654960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).