N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

C14H7BrF2N2O3 — CID 3245278

IUPACN-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1c(F)cc(F)cc1Br)c1cc(-c2ccco2)on1
InChIInChI=1S/C14H7BrF2N2O3/c15-8-4-7(16)5-9(17)13(8)18-14(20)10-6-12(22-19-10)11-2-1-3-21-11/h1-6H,(H,18,20)
InChIKeyXQUMECSCHHNHHN-UHFFFAOYSA-N
MW369.12 g/mol
LogP4.23
Rot. Bonds3

About N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 3245278) has the molecular formula C14H7BrF2N2O3 and a molecular weight of 369.12 g/mol. Its IUPAC name is N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID3245278
Molecular FormulaC14H7BrF2N2O3
Molecular Weight369.12 g/mol
Exact Mass367.96
IUPAC NameN-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1c(F)cc(F)cc1Br)c1cc(-c2ccco2)on1
InChIInChI=1S/C14H7BrF2N2O3/c15-8-4-7(16)5-9(17)13(8)18-14(20)10-6-12(22-19-10)11-2-1-3-21-11/h1-6H,(H,18,20)
InChIKeyXQUMECSCHHNHHN-UHFFFAOYSA-N
XLogP4.23
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.12
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-4,6-difluorophenyl)furan-2-carboxamide
CID 1244098
N-(2-bromo-4,6-difluorophenyl)-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 3245080
N-(5-bromo-2-hydroxyphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 15995144
N-[4-fluoro-3-(trifluoromethyl)phenyl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 71884102
5-(furan-2-yl)-N-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide
CID 24739268
5-(furan-2-yl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-1,2-oxazole-3-carboxamide
CID 78927797
5-(furan-2-yl)-1,2-oxazole-3-carbonyl chloride
CID 2795555
N-(2-bromo-4,6-difluorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62167720
5-(furan-2-yl)-N-(3-iodophenyl)-1,2-oxazole-3-carboxamide
CID 24663749
N-(3,4-dimethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 3244522
2-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]-N-(2-bromo-4,6-difluorophenyl)acetamide
CID 5293192
N-[1-(4-bromophenyl)cyclopropyl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 75493636

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 3245278) is N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is O=C(Nc1c(F)cc(F)cc1Br)c1cc(-c2ccco2)on1.
What is the InChIKey of N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is XQUMECSCHHNHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7BrF2N2O3/c15-8-4-7(16)5-9(17)13(8)18-14(20)10-6-12(22-19-10)11-2-1-3-21-11/h1-6H,(H,18,20).
What are the key properties of N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 369.12 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4,6-difluorophenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3245278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).