N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide

C10H6F2N2O2 — CID 110865329

IUPACN-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cnoc1
InChIInChI=1S/C10H6F2N2O2/c11-8-2-1-7(3-9(8)12)14-10(15)6-4-13-16-5-6/h1-5H,(H,14,15)
InChIKeyKFXPJJJBUVXJGJ-UHFFFAOYSA-N
MW224.17 g/mol
LogP2.21
Rot. Bonds2

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

N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide (PubChem CID 110865329) has the molecular formula C10H6F2N2O2 and a molecular weight of 224.17 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide
PubChem CID110865329
Molecular FormulaC10H6F2N2O2
Molecular Weight224.17 g/mol
Exact Mass224.04
IUPAC NameN-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cnoc1
InChIInChI=1S/C10H6F2N2O2/c11-8-2-1-7(3-9(8)12)14-10(15)6-4-13-16-5-6/h1-5H,(H,14,15)
InChIKeyKFXPJJJBUVXJGJ-UHFFFAOYSA-N
XLogP2.21
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.17
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-2-(dimethylamino)pyrimidine-5-carboxamide
CID 53007857
N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide
CID 63864937
N-(3,4-difluorophenyl)-1,2-oxazole-5-carboxamide
CID 110693698
N-(2,4-dichlorophenyl)-1,2-oxazole-4-carboxamide
CID 110864022
6-bromo-N-(3,4-difluorophenyl)pyridine-3-carboxamide
CID 66462669
N-(3,4-difluorophenyl)-2-fluoropyridine-4-carboxamide
CID 61295443
N-(3,4-difluorophenyl)-1H-pyrrole-3-carboxamide
CID 110691221
2-(4-chloroanilino)-N-(3,4-difluorophenyl)pyrimidine-5-carboxamide
CID 109268923
4-carbamothioyl-N-(3,4-difluorophenyl)benzamide
CID 24706077
3-N-(3,4-difluorophenyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101520
2-benzamido-N-(3,4-difluorophenyl)-1,3-oxazole-4-carboxamide
CID 52907899
5-(3,4-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109200977

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide (CID 110865329) is N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1cnoc1.
What is the InChIKey of N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide?
The InChIKey is KFXPJJJBUVXJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F2N2O2/c11-8-2-1-7(3-9(8)12)14-10(15)6-4-13-16-5-6/h1-5H,(H,14,15).
What are the key properties of N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide?
N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide has a molecular weight of 224.17 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 110865329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).