4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide

C15H10FN3O2 — CID 53014054

IUPAC4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
SMILESO=C(Nc1cc(-c2cccnc2)no1)c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O2/c16-12-5-3-10(4-6-12)15(20)18-14-8-13(19-21-14)11-2-1-7-17-9-11/h1-9H,(H,18,20)
InChIKeyIEJQFMWBYINJOI-UHFFFAOYSA-N
MW283.26 g/mol
LogP3.13
Rot. Bonds3

About 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide

4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide (PubChem CID 53014054) has the molecular formula C15H10FN3O2 and a molecular weight of 283.26 g/mol. Its IUPAC name is 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
PubChem CID53014054
Molecular FormulaC15H10FN3O2
Molecular Weight283.26 g/mol
Exact Mass283.08
IUPAC Name4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide
SMILESO=C(Nc1cc(-c2cccnc2)no1)c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O2/c16-12-5-3-10(4-6-12)15(20)18-14-8-13(19-21-14)11-2-1-7-17-9-11/h1-9H,(H,18,20)
InChIKeyIEJQFMWBYINJOI-UHFFFAOYSA-N
XLogP3.13
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.26
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The IUPAC name of 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide (CID 53014054) is 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide.
What is the SMILES notation for 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The canonical SMILES for 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide is O=C(Nc1cc(-c2cccnc2)no1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
The InChIKey is IEJQFMWBYINJOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O2/c16-12-5-3-10(4-6-12)15(20)18-14-8-13(19-21-14)11-2-1-7-17-9-11/h1-9H,(H,18,20).
What are the key properties of 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide?
4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide has a molecular weight of 283.26 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(3-pyridin-3-yl-1,2-oxazol-5-yl)benzamide is sourced from PubChem (CID 53014054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).