phenyl 4-benzamido-2-hydroxybenzoate

C20H15NO4 — CID 722884

IUPACphenyl 4-benzamido-2-hydroxybenzoate
SMILESO=C(Nc1ccc(C(=O)Oc2ccccc2)c(O)c1)c1ccccc1
InChIInChI=1S/C20H15NO4/c22-18-13-15(21-19(23)14-7-3-1-4-8-14)11-12-17(18)20(24)25-16-9-5-2-6-10-16/h1-13,22H,(H,21,23)
InChIKeyNMKYSNBCAZHQIO-UHFFFAOYSA-N
MW333.34 g/mol
LogP3.86
Rot. Bonds4

About phenyl 4-benzamido-2-hydroxybenzoate

phenyl 4-benzamido-2-hydroxybenzoate (PubChem CID 722884) has the molecular formula C20H15NO4 and a molecular weight of 333.34 g/mol. Its IUPAC name is phenyl 4-benzamido-2-hydroxybenzoate.

Molecular Properties

Compound Namephenyl 4-benzamido-2-hydroxybenzoate
PubChem CID722884
Molecular FormulaC20H15NO4
Molecular Weight333.34 g/mol
Exact Mass333.10
IUPAC Namephenyl 4-benzamido-2-hydroxybenzoate
SMILESO=C(Nc1ccc(C(=O)Oc2ccccc2)c(O)c1)c1ccccc1
InChIInChI=1S/C20H15NO4/c22-18-13-15(21-19(23)14-7-3-1-4-8-14)11-12-17(18)20(24)25-16-9-5-2-6-10-16/h1-13,22H,(H,21,23)
InChIKeyNMKYSNBCAZHQIO-UHFFFAOYSA-N
XLogP3.86
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.34
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phenyl 4-benzamido-2-hydroxybenzoate?
The IUPAC name of phenyl 4-benzamido-2-hydroxybenzoate (CID 722884) is phenyl 4-benzamido-2-hydroxybenzoate.
What is the SMILES notation for phenyl 4-benzamido-2-hydroxybenzoate?
The canonical SMILES for phenyl 4-benzamido-2-hydroxybenzoate is O=C(Nc1ccc(C(=O)Oc2ccccc2)c(O)c1)c1ccccc1.
What is the InChIKey of phenyl 4-benzamido-2-hydroxybenzoate?
The InChIKey is NMKYSNBCAZHQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO4/c22-18-13-15(21-19(23)14-7-3-1-4-8-14)11-12-17(18)20(24)25-16-9-5-2-6-10-16/h1-13,22H,(H,21,23).
What are the key properties of phenyl 4-benzamido-2-hydroxybenzoate?
phenyl 4-benzamido-2-hydroxybenzoate has a molecular weight of 333.34 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl 4-benzamido-2-hydroxybenzoate is sourced from PubChem (CID 722884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).