N-phenyl-N'-pyridin-2-yloxamide

C13H11N3O2 — CID 3147333

IUPACN-phenyl-N'-pyridin-2-yloxamide
SMILESO=C(Nc1ccccc1)C(=O)Nc1ccccn1
InChIInChI=1S/C13H11N3O2/c17-12(15-10-6-2-1-3-7-10)13(18)16-11-8-4-5-9-14-11/h1-9H,(H,15,17)(H,14,16,18)
InChIKeyQIIUXNWXFMRHBQ-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.66
Rot. Bonds2

About N-phenyl-N'-pyridin-2-yloxamide

N-phenyl-N'-pyridin-2-yloxamide (PubChem CID 3147333) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-phenyl-N'-pyridin-2-yloxamide.

Molecular Properties

Compound NameN-phenyl-N'-pyridin-2-yloxamide
PubChem CID3147333
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC NameN-phenyl-N'-pyridin-2-yloxamide
SMILESO=C(Nc1ccccc1)C(=O)Nc1ccccn1
InChIInChI=1S/C13H11N3O2/c17-12(15-10-6-2-1-3-7-10)13(18)16-11-8-4-5-9-14-11/h1-9H,(H,15,17)(H,14,16,18)
InChIKeyQIIUXNWXFMRHBQ-UHFFFAOYSA-N
XLogP1.66
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-N'-pyridin-2-yloxamide?
The IUPAC name of N-phenyl-N'-pyridin-2-yloxamide (CID 3147333) is N-phenyl-N'-pyridin-2-yloxamide.
What is the SMILES notation for N-phenyl-N'-pyridin-2-yloxamide?
The canonical SMILES for N-phenyl-N'-pyridin-2-yloxamide is O=C(Nc1ccccc1)C(=O)Nc1ccccn1.
What is the InChIKey of N-phenyl-N'-pyridin-2-yloxamide?
The InChIKey is QIIUXNWXFMRHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-12(15-10-6-2-1-3-7-10)13(18)16-11-8-4-5-9-14-11/h1-9H,(H,15,17)(H,14,16,18).
What are the key properties of N-phenyl-N'-pyridin-2-yloxamide?
N-phenyl-N'-pyridin-2-yloxamide has a molecular weight of 241.25 g/mol, XLogP of 1.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N'-pyridin-2-yloxamide is sourced from PubChem (CID 3147333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).