4-hydroxy-N-(3-nitrophenyl)benzamide

C13H10N2O4 — CID 22759587

IUPAC4-hydroxy-N-(3-nitrophenyl)benzamide
SMILESO=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(O)cc1
InChIInChI=1S/C13H10N2O4/c16-12-6-4-9(5-7-12)13(17)14-10-2-1-3-11(8-10)15(18)19/h1-8,16H,(H,14,17)
InChIKeyHNOAWUCPHWRRLC-UHFFFAOYSA-N
MW258.23 g/mol
LogP2.55
Rot. Bonds3

About 4-hydroxy-N-(3-nitrophenyl)benzamide

4-hydroxy-N-(3-nitrophenyl)benzamide (PubChem CID 22759587) has the molecular formula C13H10N2O4 and a molecular weight of 258.23 g/mol. Its IUPAC name is 4-hydroxy-N-(3-nitrophenyl)benzamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-nitrophenyl)benzamide
PubChem CID22759587
Molecular FormulaC13H10N2O4
Molecular Weight258.23 g/mol
Exact Mass258.06
IUPAC Name4-hydroxy-N-(3-nitrophenyl)benzamide
SMILESO=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(O)cc1
InChIInChI=1S/C13H10N2O4/c16-12-6-4-9(5-7-12)13(17)14-10-2-1-3-11(8-10)15(18)19/h1-8,16H,(H,14,17)
InChIKeyHNOAWUCPHWRRLC-UHFFFAOYSA-N
XLogP2.55
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.23
LogP ≤ 52.55
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

5-hydroxy-1-N,3-N-bis(3-nitrophenyl)benzene-1,3-dicarboxamide
CID 15745029
3-[(4-nitrobenzoyl)amino]-N-(3-nitrophenyl)benzamide
CID 17259456
4-N-(3-nitrophenyl)-1-N-[2-[[4-[(3-nitrophenyl)carbamoyl]benzoyl]amino]ethyl]benzene-1,4-dicarboxamide
CID 22152538
N-(3-nitrophenyl)-4-phenoxybenzamide
CID 7965638
3-nitro-N-[3-[(3-nitrobenzoyl)amino]phenyl]benzamide;hydrate
CID 45052608
4-(cyclopropanecarbonylamino)-N-(3-nitrophenyl)benzamide
CID 17359573
4-(methylsulfamoyl)-N-(3-nitrophenyl)benzamide
CID 29200413
N-(3-nitrophenyl)-4-thiophen-2-ylbenzamide
CID 4730837
N-[3-(3-nitrophenyl)phenyl]pyridine-4-carboxamide
CID 110444896
1-(3-hydroxyphenyl)-3-(3-nitrophenyl)urea
CID 28540569
4-(tert-butylsulfamoyl)-N-(3-nitrophenyl)benzamide
CID 34682520
3-[(3-nitrobenzoyl)amino]benzamide
CID 25431511

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-nitrophenyl)benzamide?
The IUPAC name of 4-hydroxy-N-(3-nitrophenyl)benzamide (CID 22759587) is 4-hydroxy-N-(3-nitrophenyl)benzamide.
What is the SMILES notation for 4-hydroxy-N-(3-nitrophenyl)benzamide?
The canonical SMILES for 4-hydroxy-N-(3-nitrophenyl)benzamide is O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(3-nitrophenyl)benzamide?
The InChIKey is HNOAWUCPHWRRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O4/c16-12-6-4-9(5-7-12)13(17)14-10-2-1-3-11(8-10)15(18)19/h1-8,16H,(H,14,17).
What are the key properties of 4-hydroxy-N-(3-nitrophenyl)benzamide?
4-hydroxy-N-(3-nitrophenyl)benzamide has a molecular weight of 258.23 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-nitrophenyl)benzamide is sourced from PubChem (CID 22759587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).