[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol

C14H13FN2O — CID 169384111

IUPAC[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol
SMILESOCc1ccc(C=NNc2ccccc2)cc1F
InChIInChI=1S/C14H13FN2O/c15-14-8-11(6-7-12(14)10-18)9-16-17-13-4-2-1-3-5-13/h1-9,17-18H,10H2
InChIKeyHNNRQNHQRZBGPH-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.76
Rot. Bonds4

About [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol

[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol (PubChem CID 169384111) has the molecular formula C14H13FN2O and a molecular weight of 244.27 g/mol. Its IUPAC name is [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol.

Molecular Properties

Compound Name[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol
PubChem CID169384111
Molecular FormulaC14H13FN2O
Molecular Weight244.27 g/mol
Exact Mass244.10
IUPAC Name[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol
SMILESOCc1ccc(C=NNc2ccccc2)cc1F
InChIInChI=1S/C14H13FN2O/c15-14-8-11(6-7-12(14)10-18)9-16-17-13-4-2-1-3-5-13/h1-9,17-18H,10H2
InChIKeyHNNRQNHQRZBGPH-UHFFFAOYSA-N
XLogP2.76
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-[(Z)-(3,4-difluorophenyl)methylideneamino]aniline
CID 6107807
[2-fluoro-4-[[(4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenyl]methanol
CID 168577581
N-[[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methylideneamino]aniline
CID 169382016
N-[[3-fluoro-4-[(3-methylpiperidin-1-yl)methyl]phenyl]methylideneamino]aniline
CID 169382048
N-[(3,5-difluorophenyl)methylideneamino]aniline
CID 169381503
N-[[3-(2-fluorophenyl)phenyl]methylideneamino]aniline
CID 169382256
N-[[4-fluoro-3-(trifluoromethoxy)phenyl]methylideneamino]aniline
CID 169382931
N-[[1-[(2-fluorophenyl)methyl]indol-6-yl]methylideneamino]aniline
CID 169383155
2-iodo-4-[(Z)-(phenylhydrazinylidene)methyl]phenol
CID 137080181
2-bromo-4-[(E)-(phenylhydrazinylidene)methyl]phenol
CID 135683062
N-[(E)-[4-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]aniline
CID 110339740
N-[(Z)-(4-phenylphenyl)methylideneamino]aniline
CID 5356673

Frequently Asked Questions

What is the IUPAC name of [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol?
The IUPAC name of [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol (CID 169384111) is [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol.
What is the SMILES notation for [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol?
The canonical SMILES for [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol is OCc1ccc(C=NNc2ccccc2)cc1F.
What is the InChIKey of [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol?
The InChIKey is HNNRQNHQRZBGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O/c15-14-8-11(6-7-12(14)10-18)9-16-17-13-4-2-1-3-5-13/h1-9,17-18H,10H2.
What are the key properties of [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol?
[2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol has a molecular weight of 244.27 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-4-[(phenylhydrazinylidene)methyl]phenyl]methanol is sourced from PubChem (CID 169384111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).