N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide

C13H9FN2O4 — CID 110483155

IUPACN-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1[N+](=O)[O-])c1ccc(O)cc1
InChIInChI=1S/C13H9FN2O4/c14-9-3-6-11(12(7-9)16(19)20)15-13(18)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,18)
InChIKeyYSEAODDRSZQYNZ-UHFFFAOYSA-N
MW276.22 g/mol
LogP2.69
Rot. Bonds3

About N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide

N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide (PubChem CID 110483155) has the molecular formula C13H9FN2O4 and a molecular weight of 276.22 g/mol. Its IUPAC name is N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide
PubChem CID110483155
Molecular FormulaC13H9FN2O4
Molecular Weight276.22 g/mol
Exact Mass276.05
IUPAC NameN-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1[N+](=O)[O-])c1ccc(O)cc1
InChIInChI=1S/C13H9FN2O4/c14-9-3-6-11(12(7-9)16(19)20)15-13(18)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,18)
InChIKeyYSEAODDRSZQYNZ-UHFFFAOYSA-N
XLogP2.69
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.22
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

4-(chloromethyl)-N-(4-fluoro-2-nitrophenyl)benzamide
CID 43346653
4-bromo-N-(4-hydroxy-2-nitrophenyl)benzamide
CID 60954513
2-amino-5-fluoro-N-(4-hydroxy-2-nitrophenyl)benzamide
CID 43695935
N-(4-fluoro-2-nitrophenyl)-1H-pyrazole-4-carboxamide
CID 61260209
2-bromo-4-fluoro-N-(4-hydroxy-2-nitrophenyl)benzamide
CID 60954645
(4-fluoro-2-nitrophenyl)urea
CID 69476086
4-fluoro-N-(2-fluoro-4-hydroxyphenyl)-2-nitrobenzamide
CID 75502193
4-(3-chloro-2-pyridinyl)-N-(4-fluoro-2-nitrophenyl)benzamide
CID 11485559
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
N-(2,3-dimethyl-4-nitrophenyl)-4-fluorobenzamide
CID 2938533
N-(5-fluoro-2-nitrophenyl)-3-hydroxybenzamide
CID 110462704
N'-(2,4-dinitrophenyl)-4-fluorobenzohydrazide
CID 4507199

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide?
The IUPAC name of N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide (CID 110483155) is N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide.
What is the SMILES notation for N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide?
The canonical SMILES for N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide is O=C(Nc1ccc(F)cc1[N+](=O)[O-])c1ccc(O)cc1.
What is the InChIKey of N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide?
The InChIKey is YSEAODDRSZQYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2O4/c14-9-3-6-11(12(7-9)16(19)20)15-13(18)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,18).
What are the key properties of N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide?
N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide has a molecular weight of 276.22 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-nitrophenyl)-4-hydroxybenzamide is sourced from PubChem (CID 110483155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).