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

C15H12FN5O2 — CID 53162263

IUPACN-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESO=C(Cc1nnc(-c2cnccn2)o1)NCc1ccc(F)cc1
InChIInChI=1S/C15H12FN5O2/c16-11-3-1-10(2-4-11)8-19-13(22)7-14-20-21-15(23-14)12-9-17-5-6-18-12/h1-6,9H,7-8H2,(H,19,22)
InChIKeyJZCATBKPDVGSPY-UHFFFAOYSA-N
MW313.29 g/mol
LogP1.52
Rot. Bonds5

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

N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 53162263) has the molecular formula C15H12FN5O2 and a molecular weight of 313.29 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID53162263
Molecular FormulaC15H12FN5O2
Molecular Weight313.29 g/mol
Exact Mass313.10
IUPAC NameN-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESO=C(Cc1nnc(-c2cnccn2)o1)NCc1ccc(F)cc1
InChIInChI=1S/C15H12FN5O2/c16-11-3-1-10(2-4-11)8-19-13(22)7-14-20-21-15(23-14)12-9-17-5-6-18-12/h1-6,9H,7-8H2,(H,19,22)
InChIKeyJZCATBKPDVGSPY-UHFFFAOYSA-N
XLogP1.52
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.29
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide (CID 53162263) is N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide is O=C(Cc1nnc(-c2cnccn2)o1)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is JZCATBKPDVGSPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN5O2/c16-11-3-1-10(2-4-11)8-19-13(22)7-14-20-21-15(23-14)12-9-17-5-6-18-12/h1-6,9H,7-8H2,(H,19,22).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 313.29 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 53162263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).