5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide

C14H10BrFN2O2 — CID 762173

IUPAC5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(NN=Cc1ccccc1F)c1cc(Br)ccc1O
InChIInChI=1S/C14H10BrFN2O2/c15-10-5-6-13(19)11(7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20)
InChIKeyKFDOGUSERGADPK-UHFFFAOYSA-N
MW337.15 g/mol
LogP3.06
Rot. Bonds3

About 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide

5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide (PubChem CID 762173) has the molecular formula C14H10BrFN2O2 and a molecular weight of 337.15 g/mol. Its IUPAC name is 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
PubChem CID762173
Molecular FormulaC14H10BrFN2O2
Molecular Weight337.15 g/mol
Exact Mass335.99
IUPAC Name5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESO=C(NN=Cc1ccccc1F)c1cc(Br)ccc1O
InChIInChI=1S/C14H10BrFN2O2/c15-10-5-6-13(19)11(7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20)
InChIKeyKFDOGUSERGADPK-UHFFFAOYSA-N
XLogP3.06
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.15
LogP ≤ 53.06
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)-(5-bromo-2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 5335710
N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 674709
4-bromo-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135511246
2-fluoro-N-[(2-fluorophenyl)methylideneamino]benzamide
CID 2593233
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-5-chloro-2-hydroxybenzamide
CID 135615369
N-[(E)-(2-fluorophenyl)methylideneamino]-2,4-dihydroxybenzamide
CID 5333882
4-chloro-N-[(Z)-(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 5405746
2-bromo-N-[(5-bromo-2-hydroxyphenyl)methylideneamino]benzamide
CID 4135115
5-bromo-2-hydroxy-N-[(Z)-1H-indol-3-ylmethylideneamino]benzamide
CID 136711415
5-bromo-2-hydroxy-N-[(2-pentoxyphenyl)methylideneamino]benzamide
CID 3538780
N-(anthracen-9-ylmethylideneamino)-5-bromo-2-hydroxybenzamide
CID 71960210
N-[(E)-(3-fluoro-2-hydroxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 135959957

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The IUPAC name of 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide (CID 762173) is 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide.
What is the SMILES notation for 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The canonical SMILES for 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide is O=C(NN=Cc1ccccc1F)c1cc(Br)ccc1O.
What is the InChIKey of 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
The InChIKey is KFDOGUSERGADPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrFN2O2/c15-10-5-6-13(19)11(7-10)14(20)18-17-8-9-3-1-2-4-12(9)16/h1-8,19H,(H,18,20).
What are the key properties of 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide?
5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide has a molecular weight of 337.15 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide is sourced from PubChem (CID 762173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).