N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide

C10H6BrFN2O2 — CID 65430131

IUPACN-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1ccc(Br)c(F)c1)c1ccon1
InChIInChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)13-10(15)9-3-4-16-14-9/h1-5H,(H,13,15)
InChIKeyLNAHTWDHUUWWSL-UHFFFAOYSA-N
MW285.07 g/mol
LogP2.83
Rot. Bonds2

About N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide

N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide (PubChem CID 65430131) has the molecular formula C10H6BrFN2O2 and a molecular weight of 285.07 g/mol. Its IUPAC name is N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide
PubChem CID65430131
Molecular FormulaC10H6BrFN2O2
Molecular Weight285.07 g/mol
Exact Mass283.96
IUPAC NameN-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1ccc(Br)c(F)c1)c1ccon1
InChIInChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)13-10(15)9-3-4-16-14-9/h1-5H,(H,13,15)
InChIKeyLNAHTWDHUUWWSL-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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Related Compounds

N-(5-bromo-4-fluoro-2-methylphenyl)-1,2-oxazole-3-carboxamide
CID 103274989
N-[4-(3-aminoprop-1-ynyl)-3-fluorophenyl]-1,2-oxazole-3-carboxamide
CID 65435499
N-(6-bromo-3-pyridinyl)-1,2-oxazole-3-carboxamide
CID 103789487
4-bromo-N-(4-bromo-3-fluorophenyl)-3-fluorobenzamide
CID 65435198
N-(4-bromo-3-fluorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 65435257
N-(4-bromo-3-fluorophenyl)quinoline-2-carboxamide
CID 65435460
N-(4-bromo-3-fluorophenyl)-2-fluorobenzamide
CID 65436517
N-[4-(chloromethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 114299970
1-(4-bromo-3-fluorophenyl)-3-(3,4-dichlorophenyl)urea
CID 65431622
N-(4-bromo-3-fluorophenyl)-6-chloropyridine-3-carboxamide
CID 65435923
N-(4-bromo-3-fluorophenyl)-3,6-dichloropyridazine-4-carboxamide
CID 114038522
5-bromo-N-(4-bromo-3-fluorophenyl)-2-fluorobenzamide
CID 65438137

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide (CID 65430131) is N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide is O=C(Nc1ccc(Br)c(F)c1)c1ccon1.
What is the InChIKey of N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is LNAHTWDHUUWWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrFN2O2/c11-7-2-1-6(5-8(7)12)13-10(15)9-3-4-16-14-9/h1-5H,(H,13,15).
What are the key properties of N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide?
N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide 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 N-(4-bromo-3-fluorophenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 65430131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).