2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide

C20H15N3O3 — CID 177381501

IUPAC2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccccc2)nc1OCC(=O)NO
InChIInChI=1S/C20H15N3O3/c21-12-17-16(14-7-3-1-4-8-14)11-18(15-9-5-2-6-10-15)22-20(17)26-13-19(24)23-25/h1-11,25H,13H2,(H,23,24)
InChIKeyXHPAVNWBZMSZDE-UHFFFAOYSA-N
MW345.36 g/mol
LogP3.17
Rot. Bonds5

About 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide

2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide (PubChem CID 177381501) has the molecular formula C20H15N3O3 and a molecular weight of 345.36 g/mol. Its IUPAC name is 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide
PubChem CID177381501
Molecular FormulaC20H15N3O3
Molecular Weight345.36 g/mol
Exact Mass345.11
IUPAC Name2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccccc2)nc1OCC(=O)NO
InChIInChI=1S/C20H15N3O3/c21-12-17-16(14-7-3-1-4-8-14)11-18(15-9-5-2-6-10-15)22-20(17)26-13-19(24)23-25/h1-11,25H,13H2,(H,23,24)
InChIKeyXHPAVNWBZMSZDE-UHFFFAOYSA-N
XLogP3.17
TPSA95.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', '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-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide?
The IUPAC name of 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide (CID 177381501) is 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide.
What is the SMILES notation for 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide?
The canonical SMILES for 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide is N#Cc1c(-c2ccccc2)cc(-c2ccccc2)nc1OCC(=O)NO.
What is the InChIKey of 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide?
The InChIKey is XHPAVNWBZMSZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O3/c21-12-17-16(14-7-3-1-4-8-14)11-18(15-9-5-2-6-10-15)22-20(17)26-13-19(24)23-25/h1-11,25H,13H2,(H,23,24).
What are the key properties of 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide?
2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide has a molecular weight of 345.36 g/mol, XLogP of 3.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)oxy]-N-hydroxyacetamide is sourced from PubChem (CID 177381501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).