4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol

C12H9FN2O — CID 135908107

IUPAC4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol
SMILESOc1ccc(F)cc1/C=N/c1ccccn1
InChIInChI=1S/C12H9FN2O/c13-10-4-5-11(16)9(7-10)8-15-12-3-1-2-6-14-12/h1-8,16H/b15-8+
InChIKeyGLJNSQNAIFAYQA-OVCLIPMQSA-N
MW216.22 g/mol
LogP2.68
Rot. Bonds2

About 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol

4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol (PubChem CID 135908107) has the molecular formula C12H9FN2O and a molecular weight of 216.22 g/mol. Its IUPAC name is 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol.

Molecular Properties

Compound Name4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol
PubChem CID135908107
Molecular FormulaC12H9FN2O
Molecular Weight216.22 g/mol
Exact Mass216.07
IUPAC Name4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol
SMILESOc1ccc(F)cc1/C=N/c1ccccn1
InChIInChI=1S/C12H9FN2O/c13-10-4-5-11(16)9(7-10)8-15-12-3-1-2-6-14-12/h1-8,16H/b15-8+
InChIKeyGLJNSQNAIFAYQA-OVCLIPMQSA-N
XLogP2.68
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-2-[(E)-pyridin-2-yliminomethyl]phenol
CID 137141289
2,4-dibromo-6-[(E)-pyridin-2-yliminomethyl]phenol
CID 135458806
2,4-diiodo-6-(pyridin-2-yliminomethyl)phenol
CID 3640337
2-ethoxy-6-[(E)-pyridin-2-yliminomethyl]phenol
CID 135515677
4-fluoro-2-[(phenylhydrazinylidene)methyl]phenol
CID 169381557
1-[2-[(5-fluoro-2-hydroxyphenyl)methylideneamino]naphthalen-1-yl]naphthalen-2-ol
CID 136697424
2-[(4-fluorophenyl)iminomethyl]-4-nitrosophenol
CID 142621660
copper;bis(2-[(4-methyl-2-pyridinyl)iminomethyl]phenol)
CID 137200643
2-[(4-ethyl-2-pyridinyl)iminomethyl]phenol
CID 135427221
1-(2-phenylmethoxyphenyl)-N-pyridin-2-ylmethanimine
CID 4779340
4-bromo-2-[(4-methyl-2-pyridinyl)iminomethyl]phenol
CID 869448
2-[(5-fluoro-2-hydroxyphenyl)methylideneamino]guanidine
CID 168592804

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol?
The IUPAC name of 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol (CID 135908107) is 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol.
What is the SMILES notation for 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol?
The canonical SMILES for 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol is Oc1ccc(F)cc1/C=N/c1ccccn1.
What is the InChIKey of 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol?
The InChIKey is GLJNSQNAIFAYQA-OVCLIPMQSA-N. The full InChI is InChI=1S/C12H9FN2O/c13-10-4-5-11(16)9(7-10)8-15-12-3-1-2-6-14-12/h1-8,16H/b15-8+.
What are the key properties of 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol?
4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol has a molecular weight of 216.22 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol is sourced from PubChem (CID 135908107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).