2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide

C20H17N3O2 — CID 5220339

IUPAC2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide
SMILESO=C(NN=C(c1ccccc1)c1ccccn1)C(O)c1ccccc1
InChIInChI=1S/C20H17N3O2/c24-19(16-11-5-2-6-12-16)20(25)23-22-18(15-9-3-1-4-10-15)17-13-7-8-14-21-17/h1-14,19,24H,(H,23,25)
InChIKeyXKAHRHPAGAUERS-UHFFFAOYSA-N
MW331.38 g/mol
LogP2.68
Rot. Bonds5

About 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide

2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide (PubChem CID 5220339) has the molecular formula C20H17N3O2 and a molecular weight of 331.38 g/mol. Its IUPAC name is 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide.

Molecular Properties

Compound Name2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide
PubChem CID5220339
Molecular FormulaC20H17N3O2
Molecular Weight331.38 g/mol
Exact Mass331.13
IUPAC Name2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide
SMILESO=C(NN=C(c1ccccc1)c1ccccn1)C(O)c1ccccc1
InChIInChI=1S/C20H17N3O2/c24-19(16-11-5-2-6-12-16)20(25)23-22-18(15-9-3-1-4-10-15)17-13-7-8-14-21-17/h1-14,19,24H,(H,23,25)
InChIKeyXKAHRHPAGAUERS-UHFFFAOYSA-N
XLogP2.68
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide?
The IUPAC name of 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide (CID 5220339) is 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide.
What is the SMILES notation for 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide?
The canonical SMILES for 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide is O=C(NN=C(c1ccccc1)c1ccccn1)C(O)c1ccccc1.
What is the InChIKey of 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide?
The InChIKey is XKAHRHPAGAUERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2/c24-19(16-11-5-2-6-12-16)20(25)23-22-18(15-9-3-1-4-10-15)17-13-7-8-14-21-17/h1-14,19,24H,(H,23,25).
What are the key properties of 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide?
2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide has a molecular weight of 331.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-phenyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]acetamide is sourced from PubChem (CID 5220339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).