N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide

C23H18FN3O2 — CID 16917558

IUPACN-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide
SMILESO=C(Nc1nnc(Cc2ccc(F)cc2)o1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H18FN3O2/c24-19-13-11-16(12-14-19)15-20-26-27-23(29-20)25-22(28)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,21H,15H2,(H,25,27,28)
InChIKeyUXORKGZSDIOKSA-UHFFFAOYSA-N
MW387.41 g/mol
LogP4.57
Rot. Bonds6

About N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide

N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide (PubChem CID 16917558) has the molecular formula C23H18FN3O2 and a molecular weight of 387.41 g/mol. Its IUPAC name is N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide
PubChem CID16917558
Molecular FormulaC23H18FN3O2
Molecular Weight387.41 g/mol
Exact Mass387.14
IUPAC NameN-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide
SMILESO=C(Nc1nnc(Cc2ccc(F)cc2)o1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H18FN3O2/c24-19-13-11-16(12-14-19)15-20-26-27-23(29-20)25-22(28)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,21H,15H2,(H,25,27,28)
InChIKeyUXORKGZSDIOKSA-UHFFFAOYSA-N
XLogP4.57
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.41
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide?
The IUPAC name of N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide (CID 16917558) is N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide?
The canonical SMILES for N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide is O=C(Nc1nnc(Cc2ccc(F)cc2)o1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide?
The InChIKey is UXORKGZSDIOKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O2/c24-19-13-11-16(12-14-19)15-20-26-27-23(29-20)25-22(28)21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,21H,15H2,(H,25,27,28).
What are the key properties of N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide?
N-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide has a molecular weight of 387.41 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-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide is sourced from PubChem (CID 16917558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).