5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide

C12H8FN3O4 — CID 71403106

IUPAC5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc([N+](=O)[O-])cn1)c1cc(F)ccc1O
InChIInChI=1S/C12H8FN3O4/c13-7-1-3-10(17)9(5-7)12(18)15-11-4-2-8(6-14-11)16(19)20/h1-6,17H,(H,14,15,18)
InChIKeyQZTLCSHYVJTZHW-UHFFFAOYSA-N
MW277.21 g/mol
LogP2.09
Rot. Bonds3

About 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide

5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide (PubChem CID 71403106) has the molecular formula C12H8FN3O4 and a molecular weight of 277.21 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide
PubChem CID71403106
Molecular FormulaC12H8FN3O4
Molecular Weight277.21 g/mol
Exact Mass277.05
IUPAC Name5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc([N+](=O)[O-])cn1)c1cc(F)ccc1O
InChIInChI=1S/C12H8FN3O4/c13-7-1-3-10(17)9(5-7)12(18)15-11-4-2-8(6-14-11)16(19)20/h1-6,17H,(H,14,15,18)
InChIKeyQZTLCSHYVJTZHW-UHFFFAOYSA-N
XLogP2.09
TPSA105.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.21
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-[(5-fluoro-2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 115298481
3-fluoro-5-methyl-N-(5-nitro-2-pyridinyl)benzamide
CID 162519913
4,5-difluoro-N-(5-fluoro-2-pyridinyl)-2-nitrobenzamide
CID 63235900
4-bromo-N-(5-nitro-2-pyridinyl)benzamide
CID 4180609
N-(5-chloropyrazin-2-yl)-5-fluoro-2-nitrobenzamide
CID 107595834
3,5-dimethoxy-N-(5-nitro-2-pyridinyl)benzamide
CID 2862603
N-(4-fluorophenyl)-5-nitropyridin-2-amine
CID 3146297
5-fluoro-2-hydroxy-N-(1,2-oxazol-3-yl)benzamide
CID 115299087
2-amino-5-fluoro-N-(4-nitrophenyl)benzamide
CID 43245709
2-amino-N-(5-bromo-2-pyridinyl)-5-nitrobenzamide
CID 62155081
3-chloro-4-nitro-N-(5-nitro-2-pyridinyl)benzamide
CID 11834512
N-(5-ethyl-1H-pyrazol-3-yl)-5-fluoro-2-hydroxybenzamide
CID 112697504

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide (CID 71403106) is 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide is O=C(Nc1ccc([N+](=O)[O-])cn1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide?
The InChIKey is QZTLCSHYVJTZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3O4/c13-7-1-3-10(17)9(5-7)12(18)15-11-4-2-8(6-14-11)16(19)20/h1-6,17H,(H,14,15,18).
What are the key properties of 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide?
5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide has a molecular weight of 277.21 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-(5-nitro-2-pyridinyl)benzamide is sourced from PubChem (CID 71403106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).