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

C15H10F3N5O2 — CID 53162214

IUPAC2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1nnc(-c2cnccn2)o1)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10F3N5O2/c16-15(17,18)9-1-3-10(4-2-9)21-12(24)7-13-22-23-14(25-13)11-8-19-5-6-20-11/h1-6,8H,7H2,(H,21,24)
InChIKeyYYBFZBRUJYRENJ-UHFFFAOYSA-N
MW349.27 g/mol
LogP2.73
Rot. Bonds4

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

2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 53162214) has the molecular formula C15H10F3N5O2 and a molecular weight of 349.27 g/mol. Its IUPAC name is 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID53162214
Molecular FormulaC15H10F3N5O2
Molecular Weight349.27 g/mol
Exact Mass349.08
IUPAC Name2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1nnc(-c2cnccn2)o1)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10F3N5O2/c16-15(17,18)9-1-3-10(4-2-9)21-12(24)7-13-22-23-14(25-13)11-8-19-5-6-20-11/h1-6,8H,7H2,(H,21,24)
InChIKeyYYBFZBRUJYRENJ-UHFFFAOYSA-N
XLogP2.73
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide (CID 53162214) is 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide is O=C(Cc1nnc(-c2cnccn2)o1)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is YYBFZBRUJYRENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N5O2/c16-15(17,18)9-1-3-10(4-2-9)21-12(24)7-13-22-23-14(25-13)11-8-19-5-6-20-11/h1-6,8H,7H2,(H,21,24).
What are the key properties of 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide?
2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 349.27 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 53162214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).