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

C9H6F3N5O2 — CID 71576962

IUPACN-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide
SMILESCC(=O)Nc1cnc(-c2noc(C(F)(F)F)n2)cn1
InChIInChI=1S/C9H6F3N5O2/c1-4(18)15-6-3-13-5(2-14-6)7-16-8(19-17-7)9(10,11)12/h2-3H,1H3,(H,14,15,18)
InChIKeyWMAOBDKLXIMIFA-UHFFFAOYSA-N
MW273.17 g/mol
LogP1.50
Rot. Bonds2

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

N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide (PubChem CID 71576962) has the molecular formula C9H6F3N5O2 and a molecular weight of 273.17 g/mol. Its IUPAC name is N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide
PubChem CID71576962
Molecular FormulaC9H6F3N5O2
Molecular Weight273.17 g/mol
Exact Mass273.05
IUPAC NameN-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide
SMILESCC(=O)Nc1cnc(-c2noc(C(F)(F)F)n2)cn1
InChIInChI=1S/C9H6F3N5O2/c1-4(18)15-6-3-13-5(2-14-6)7-16-8(19-17-7)9(10,11)12/h2-3H,1H3,(H,14,15,18)
InChIKeyWMAOBDKLXIMIFA-UHFFFAOYSA-N
XLogP1.50
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.17
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide?
The IUPAC name of N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide (CID 71576962) is N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide.
What is the SMILES notation for N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide?
The canonical SMILES for N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide is CC(=O)Nc1cnc(-c2noc(C(F)(F)F)n2)cn1.
What is the InChIKey of N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide?
The InChIKey is WMAOBDKLXIMIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3N5O2/c1-4(18)15-6-3-13-5(2-14-6)7-16-8(19-17-7)9(10,11)12/h2-3H,1H3,(H,14,15,18).
What are the key properties of N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide?
N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide has a molecular weight of 273.17 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]pyrazin-2-yl]acetamide is sourced from PubChem (CID 71576962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).