5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide

C15H11N3O2 — CID 973865

IUPAC5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C15H11N3O2/c19-15(17-12-7-4-8-16-10-12)13-9-14(20-18-13)11-5-2-1-3-6-11/h1-10H,(H,17,19)
InChIKeyBBOYKJFHRWUCPG-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.99
Rot. Bonds3

About 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide

5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide (PubChem CID 973865) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide
PubChem CID973865
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Name5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(-c2ccccc2)on1
InChIInChI=1S/C15H11N3O2/c19-15(17-12-7-4-8-16-10-12)13-9-14(20-18-13)11-5-2-1-3-6-11/h1-10H,(H,17,19)
InChIKeyBBOYKJFHRWUCPG-UHFFFAOYSA-N
XLogP2.99
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide (CID 973865) is 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide is O=C(Nc1cccnc1)c1cc(-c2ccccc2)on1.
What is the InChIKey of 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide?
The InChIKey is BBOYKJFHRWUCPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-15(17-12-7-4-8-16-10-12)13-9-14(20-18-13)11-5-2-1-3-6-11/h1-10H,(H,17,19).
What are the key properties of 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide?
5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide has a molecular weight of 265.27 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-pyridin-3-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 973865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).