N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide

C7H6F3N3OS — CID 75508808

IUPACN-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide
SMILESO=C(CSC(F)(F)F)Nc1cnccn1
InChIInChI=1S/C7H6F3N3OS/c8-7(9,10)15-4-6(14)13-5-3-11-1-2-12-5/h1-3H,4H2,(H,12,13,14)
InChIKeyIGQDRHYDEBZNIN-UHFFFAOYSA-N
MW237.21 g/mol
LogP1.67
Rot. Bonds3

About N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide

N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide (PubChem CID 75508808) has the molecular formula C7H6F3N3OS and a molecular weight of 237.21 g/mol. Its IUPAC name is N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide.

Molecular Properties

Compound NameN-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide
PubChem CID75508808
Molecular FormulaC7H6F3N3OS
Molecular Weight237.21 g/mol
Exact Mass237.02
IUPAC NameN-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide
SMILESO=C(CSC(F)(F)F)Nc1cnccn1
InChIInChI=1S/C7H6F3N3OS/c8-7(9,10)15-4-6(14)13-5-3-11-1-2-12-5/h1-3H,4H2,(H,12,13,14)
InChIKeyIGQDRHYDEBZNIN-UHFFFAOYSA-N
XLogP1.67
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)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-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide?
The IUPAC name of N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide (CID 75508808) is N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide.
What is the SMILES notation for N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide?
The canonical SMILES for N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide is O=C(CSC(F)(F)F)Nc1cnccn1.
What is the InChIKey of N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide?
The InChIKey is IGQDRHYDEBZNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N3OS/c8-7(9,10)15-4-6(14)13-5-3-11-1-2-12-5/h1-3H,4H2,(H,12,13,14).
What are the key properties of N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide?
N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide has a molecular weight of 237.21 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazin-2-yl-2-(trifluoromethylsulfanyl)acetamide is sourced from PubChem (CID 75508808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).