4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide

C14H10ClFN2O2 — CID 5405746

IUPAC4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(N/N=C\c1ccccc1F)c1ccc(Cl)cc1O
InChIInChI=1S/C14H10ClFN2O2/c15-10-5-6-11(13(19)7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20)/b17-8-
InChIKeyUUDFBMKFPOKMMJ-IUXPMGMMSA-N
MW292.70 g/mol
LogP2.95
Rot. Bonds3

About 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide

4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide (PubChem CID 5405746) has the molecular formula C14H10ClFN2O2 and a molecular weight of 292.70 g/mol. Its IUPAC name is 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
PubChem CID5405746
Molecular FormulaC14H10ClFN2O2
Molecular Weight292.70 g/mol
Exact Mass292.04
IUPAC Name4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(N/N=C\c1ccccc1F)c1ccc(Cl)cc1O
InChIInChI=1S/C14H10ClFN2O2/c15-10-5-6-11(13(19)7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20)/b17-8-
InChIKeyUUDFBMKFPOKMMJ-IUXPMGMMSA-N
XLogP2.95
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.70
LogP ≤ 52.95
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-[(E)-(2-fluorophenyl)methylideneamino]-2,4-dihydroxybenzamide
CID 5333882
N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 674709
4-chloro-N-[(E)-(2,3-dichlorophenyl)methylideneamino]-2-hydroxybenzamide
CID 5333194
N-[(E)-(3-fluoro-2-hydroxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 135959957
2-fluoro-N-[(2-fluorophenyl)methylideneamino]benzamide
CID 2593233
N-[(Z)-(5-chloro-2-hydroxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 135641867
1-N-butyl-4-chloro-2-N-[(2-fluorophenyl)methylideneamino]benzene-1,2-dicarboxamide
CID 75212111
5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 762173
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-fluorobenzamide
CID 6299939
N-[(E)-(5-bromo-2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 5335710
2-chloro-N-[(2-fluorophenyl)methylideneamino]-4-nitrobenzamide
CID 4520200
N-[(E)-(2-fluorophenyl)methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 6893755

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The IUPAC name of 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide (CID 5405746) is 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide is O=C(N/N=C\c1ccccc1F)c1ccc(Cl)cc1O.
What is the InChIKey of 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The InChIKey is UUDFBMKFPOKMMJ-IUXPMGMMSA-N. The full InChI is InChI=1S/C14H10ClFN2O2/c15-10-5-6-11(13(19)7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20)/b17-8-.
What are the key properties of 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide has a molecular weight of 292.70 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide is sourced from PubChem (CID 5405746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).