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

C10H6BrFN2O2 — CID 55210906

IUPAC4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide
SMILESO=C(Nc1ccon1)c1ccc(Br)c(F)c1
InChIInChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)10(15)13-9-3-4-16-14-9/h1-5H,(H,13,14,15)
InChIKeyBQWLKJAYOIGELY-UHFFFAOYSA-N
MW285.07 g/mol
LogP2.83
Rot. Bonds2

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

4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide (PubChem CID 55210906) has the molecular formula C10H6BrFN2O2 and a molecular weight of 285.07 g/mol. Its IUPAC name is 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide
PubChem CID55210906
Molecular FormulaC10H6BrFN2O2
Molecular Weight285.07 g/mol
Exact Mass283.96
IUPAC Name4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide
SMILESO=C(Nc1ccon1)c1ccc(Br)c(F)c1
InChIInChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)10(15)13-9-3-4-16-14-9/h1-5H,(H,13,14,15)
InChIKeyBQWLKJAYOIGELY-UHFFFAOYSA-N
XLogP2.83
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.07
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide?
The IUPAC name of 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide (CID 55210906) is 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide is O=C(Nc1ccon1)c1ccc(Br)c(F)c1.
What is the InChIKey of 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide?
The InChIKey is BQWLKJAYOIGELY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)10(15)13-9-3-4-16-14-9/h1-5H,(H,13,14,15).
What are the key properties of 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide?
4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide has a molecular weight of 285.07 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-fluoro-N-(1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 55210906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).