N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide

C₁₈H₁₄N₂O₂ — CID 18109421

About N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide

N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide (PubChem CID 18109421) has the molecular formula C₁₈H₁₄N₂O₂ and a molecular weight of 290.32 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide.

Molecular Properties

• Compound Name: N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide
• PubChem CID: 18109421
• Molecular Formula: C₁₈H₁₄N₂O₂
• Molecular Weight: 290.32 g/mol
• Exact Mass: 290.11
• IUPAC Name: N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide
• SMILES: O=C(Nc1ncccc1O)c1ccc(-c2ccccc2)cc1
• InChI: InChI=1S/C18H14N2O2/c21-16-7-4-12-19-17(16)20-18(22)15-10-8-14(9-11-15)13-5-2-1-3-6-13/h1-12,21H,(H,19,20,22)
• InChIKey: KSSIEWQKURXCBN-UHFFFAOYSA-N
• XLogP: 3.71
• TPSA: 62.22 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	290.32
LogP ≤ 5	3.71
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide?

The IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide (CID 18109421) is N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide.

What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide?

The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide is O=C(Nc1ncccc1O)c1ccc(-c2ccccc2)cc1.

What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide?

The InChIKey is KSSIEWQKURXCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-16-7-4-12-19-17(16)20-18(22)15-10-8-14(9-11-15)13-5-2-1-3-6-13/h1-12,21H,(H,19,20,22).

What are the key properties of N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide?

N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide has a molecular weight of 290.32 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-hydroxy-2-pyridinyl)-4-phenylbenzamide is sourced from PubChem (CID 18109421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 18109421 — identifiers, structure, computed properties (public domain)

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