4-chloro-N-(2-hydroxyphenyl)benzamide

C13H10ClNO2 — CID 3239831

IUPAC4-chloro-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(Cl)cc1
InChIInChI=1S/C13H10ClNO2/c14-10-7-5-9(6-8-10)13(17)15-11-3-1-2-4-12(11)16/h1-8,16H,(H,15,17)
InChIKeyDZZYJYQGLGAWEU-UHFFFAOYSA-N
MW247.68 g/mol
LogP3.30
Rot. Bonds2

About 4-chloro-N-(2-hydroxyphenyl)benzamide

4-chloro-N-(2-hydroxyphenyl)benzamide (PubChem CID 3239831) has the molecular formula C13H10ClNO2 and a molecular weight of 247.68 g/mol. Its IUPAC name is 4-chloro-N-(2-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(2-hydroxyphenyl)benzamide
PubChem CID3239831
Molecular FormulaC13H10ClNO2
Molecular Weight247.68 g/mol
Exact Mass247.04
IUPAC Name4-chloro-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1ccc(Cl)cc1
InChIInChI=1S/C13H10ClNO2/c14-10-7-5-9(6-8-10)13(17)15-11-3-1-2-4-12(11)16/h1-8,16H,(H,15,17)
InChIKeyDZZYJYQGLGAWEU-UHFFFAOYSA-N
XLogP3.30
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.68
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-hydroxyphenyl)benzamide?
The IUPAC name of 4-chloro-N-(2-hydroxyphenyl)benzamide (CID 3239831) is 4-chloro-N-(2-hydroxyphenyl)benzamide.
What is the SMILES notation for 4-chloro-N-(2-hydroxyphenyl)benzamide?
The canonical SMILES for 4-chloro-N-(2-hydroxyphenyl)benzamide is O=C(Nc1ccccc1O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(2-hydroxyphenyl)benzamide?
The InChIKey is DZZYJYQGLGAWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClNO2/c14-10-7-5-9(6-8-10)13(17)15-11-3-1-2-4-12(11)16/h1-8,16H,(H,15,17).
What are the key properties of 4-chloro-N-(2-hydroxyphenyl)benzamide?
4-chloro-N-(2-hydroxyphenyl)benzamide has a molecular weight of 247.68 g/mol, XLogP of 3.30, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-hydroxyphenyl)benzamide is sourced from PubChem (CID 3239831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).