N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide

C19H15F3N2O3 — CID 43071866

IUPACN-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
SMILESCC(NC(=O)c1cc(-c2cccc(F)c2)no1)c1ccccc1OC(F)F
InChIInChI=1S/C19H15F3N2O3/c1-11(14-7-2-3-8-16(14)26-19(21)22)23-18(25)17-10-15(24-27-17)12-5-4-6-13(20)9-12/h2-11,19H,1H3,(H,23,25)
InChIKeyAZWZKWYUWCVMTN-UHFFFAOYSA-N
MW376.33 g/mol
LogP4.57
Rot. Bonds6

About N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide

N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide (PubChem CID 43071866) has the molecular formula C19H15F3N2O3 and a molecular weight of 376.33 g/mol. Its IUPAC name is N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
PubChem CID43071866
Molecular FormulaC19H15F3N2O3
Molecular Weight376.33 g/mol
Exact Mass376.10
IUPAC NameN-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
SMILESCC(NC(=O)c1cc(-c2cccc(F)c2)no1)c1ccccc1OC(F)F
InChIInChI=1S/C19H15F3N2O3/c1-11(14-7-2-3-8-16(14)26-19(21)22)23-18(25)17-10-15(24-27-17)12-5-4-6-13(20)9-12/h2-11,19H,1H3,(H,23,25)
InChIKeyAZWZKWYUWCVMTN-UHFFFAOYSA-N
XLogP4.57
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.33
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2,6-di(propan-2-yl)phenyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 43068883
N-(2-tert-butylphenyl)-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 43068926
2-(difluoromethoxy)-N-[1-(2,5-difluorophenyl)ethyl]benzamide
CID 46587974
N-[1-[2-(difluoromethoxy)phenyl]ethyl]furan-3-carboxamide
CID 42953720
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119716596
3-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1,2-oxazole-5-carboxamide
CID 103856479
N-(2,4-dimethylphenyl)-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 46471110
3-(3-fluorophenyl)-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-5-carboxamide
CID 43068966
4-amino-N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-methylbutanamide
CID 80543450
2-amino-N-[1-[2-(difluoromethoxy)phenyl]ethyl]propanamide
CID 43709973
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-methoxypropanamide
CID 112685807
N-cyclohexyl-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 46472289

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide (CID 43071866) is N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide is CC(NC(=O)c1cc(-c2cccc(F)c2)no1)c1ccccc1OC(F)F.
What is the InChIKey of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide?
The InChIKey is AZWZKWYUWCVMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O3/c1-11(14-7-2-3-8-16(14)26-19(21)22)23-18(25)17-10-15(24-27-17)12-5-4-6-13(20)9-12/h2-11,19H,1H3,(H,23,25).
What are the key properties of N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide?
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide has a molecular weight of 376.33 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(difluoromethoxy)phenyl]ethyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 43071866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).