4-hydroxy-N-(4-hydroxyphenyl)benzamide

C13H11NO3 — CID 950480

IUPAC4-hydroxy-N-(4-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C13H11NO3/c15-11-5-1-9(2-6-11)13(17)14-10-3-7-12(16)8-4-10/h1-8,15-16H,(H,14,17)
InChIKeyWCTPJCYSFNTVKJ-UHFFFAOYSA-N
MW229.24 g/mol
LogP2.35
Rot. Bonds2

About 4-hydroxy-N-(4-hydroxyphenyl)benzamide

4-hydroxy-N-(4-hydroxyphenyl)benzamide (PubChem CID 950480) has the molecular formula C13H11NO3 and a molecular weight of 229.24 g/mol. Its IUPAC name is 4-hydroxy-N-(4-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-hydroxy-N-(4-hydroxyphenyl)benzamide
PubChem CID950480
Molecular FormulaC13H11NO3
Molecular Weight229.24 g/mol
Exact Mass229.07
IUPAC Name4-hydroxy-N-(4-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C13H11NO3/c15-11-5-1-9(2-6-11)13(17)14-10-3-7-12(16)8-4-10/h1-8,15-16H,(H,14,17)
InChIKeyWCTPJCYSFNTVKJ-UHFFFAOYSA-N
XLogP2.35
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(4-hydroxyphenyl)benzamide?
The IUPAC name of 4-hydroxy-N-(4-hydroxyphenyl)benzamide (CID 950480) is 4-hydroxy-N-(4-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-hydroxy-N-(4-hydroxyphenyl)benzamide?
The canonical SMILES for 4-hydroxy-N-(4-hydroxyphenyl)benzamide is O=C(Nc1ccc(O)cc1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(4-hydroxyphenyl)benzamide?
The InChIKey is WCTPJCYSFNTVKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO3/c15-11-5-1-9(2-6-11)13(17)14-10-3-7-12(16)8-4-10/h1-8,15-16H,(H,14,17).
What are the key properties of 4-hydroxy-N-(4-hydroxyphenyl)benzamide?
4-hydroxy-N-(4-hydroxyphenyl)benzamide has a molecular weight of 229.24 g/mol, XLogP of 2.35, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(4-hydroxyphenyl)benzamide is sourced from PubChem (CID 950480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).