3-fluoro-N-hydroxybenzamide

C7H6FNO2 — CID 5082377

IUPAC3-fluoro-N-hydroxybenzamide
SMILESO=C(NO)c1cccc(F)c1
InChIInChI=1S/C7H6FNO2/c8-6-3-1-2-5(4-6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyFRYSQYMXQKXZPG-UHFFFAOYSA-N
MW155.13 g/mol
LogP0.94
Rot. Bonds1

About 3-fluoro-N-hydroxybenzamide

3-fluoro-N-hydroxybenzamide (PubChem CID 5082377) has the molecular formula C7H6FNO2 and a molecular weight of 155.13 g/mol. Its IUPAC name is 3-fluoro-N-hydroxybenzamide.

Molecular Properties

Compound Name3-fluoro-N-hydroxybenzamide
PubChem CID5082377
Molecular FormulaC7H6FNO2
Molecular Weight155.13 g/mol
Exact Mass155.04
IUPAC Name3-fluoro-N-hydroxybenzamide
SMILESO=C(NO)c1cccc(F)c1
InChIInChI=1S/C7H6FNO2/c8-6-3-1-2-5(4-6)7(10)9-11/h1-4,11H,(H,9,10)
InChIKeyFRYSQYMXQKXZPG-UHFFFAOYSA-N
XLogP0.94
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.13
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-fluoro-N-[4-(hydroxycarbamoyl)phenyl]benzamide
CID 90480202
3-fluoro-N'-sulfanylbenzohydrazide
CID 174650395
(3-fluorophenyl)-(2,3,4,5,6-pentafluorophenyl)methanone
CID 112694154
3-fluoro-N-(2-hydroxyphenyl)benzamide
CID 45029698
3-fluorobenzoyl bromide
CID 20822510
methyl 3-fluorobenzoate
CID 521184
3-fluoro-N-[3-[(3-fluorobenzoyl)amino]-2,2-dimethylpropyl]benzamide
CID 2168496
N-(2-acetamidophenyl)-3-fluorobenzamide
CID 877390
N-(2-aminoethyl)-3-fluorobenzamide;hydrochloride
CID 175851405
N-(2-bromo-3-chlorophenyl)-3-fluorobenzamide
CID 103479730
bismuth tris(3-fluorobenzoate)
CID 132504465
N'-(4-ethylbenzoyl)-3-fluorobenzohydrazide
CID 7759216

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-hydroxybenzamide?
The IUPAC name of 3-fluoro-N-hydroxybenzamide (CID 5082377) is 3-fluoro-N-hydroxybenzamide.
What is the SMILES notation for 3-fluoro-N-hydroxybenzamide?
The canonical SMILES for 3-fluoro-N-hydroxybenzamide is O=C(NO)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-hydroxybenzamide?
The InChIKey is FRYSQYMXQKXZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6FNO2/c8-6-3-1-2-5(4-6)7(10)9-11/h1-4,11H,(H,9,10).
What are the key properties of 3-fluoro-N-hydroxybenzamide?
3-fluoro-N-hydroxybenzamide has a molecular weight of 155.13 g/mol, XLogP of 0.94, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-hydroxybenzamide is sourced from PubChem (CID 5082377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).