3-(trifluoromethyl)pyrazin-2-amine

C5H4F3N3 — CID 25069463

IUPAC3-(trifluoromethyl)pyrazin-2-amine
SMILESNc1nccnc1C(F)(F)F
InChIInChI=1S/C5H4F3N3/c6-5(7,8)3-4(9)11-2-1-10-3/h1-2H,(H2,9,11)
InChIKeyGDOQHWXDKQJKLT-UHFFFAOYSA-N
MW163.10 g/mol
LogP1.08
Rot. Bonds

About 3-(trifluoromethyl)pyrazin-2-amine

3-(trifluoromethyl)pyrazin-2-amine (PubChem CID 25069463) has the molecular formula C5H4F3N3 and a molecular weight of 163.10 g/mol. Its IUPAC name is 3-(trifluoromethyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(trifluoromethyl)pyrazin-2-amine
PubChem CID25069463
Molecular FormulaC5H4F3N3
Molecular Weight163.10 g/mol
Exact Mass163.04
IUPAC Name3-(trifluoromethyl)pyrazin-2-amine
SMILESNc1nccnc1C(F)(F)F
InChIInChI=1S/C5H4F3N3/c6-5(7,8)3-4(9)11-2-1-10-3/h1-2H,(H2,9,11)
InChIKeyGDOQHWXDKQJKLT-UHFFFAOYSA-N
XLogP1.08
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.10
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-3,5-dimethylpyrazine
CID 2774764
3-Aminopyrazine-2,6-dicarbonitrile
CID 13925295
5-Methylpyrazin-2-amine
CID 313215
3-Aminopyrazine-2-carbonitrile
CID 817699
2-Amino-6-methylpyrazine
CID 12236939
2-Amino-3-methylpyrazine
CID 302284
3,6-Dimethylpyrazin-2-amine
CID 13261500
5-Aminopyrazine-2-carbonitrile
CID 13925294
3-Ethynylpyrazin-2-amine
CID 45789610
3-Ethylpyrazin-2-amine
CID 18704782
5-Bromo-3-methylpyrazin-2-amine
CID 21785147
5,6-Dimethylpyrazin-2-amine
CID 222763

Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethyl)pyrazin-2-amine?
The IUPAC name of 3-(trifluoromethyl)pyrazin-2-amine (CID 25069463) is 3-(trifluoromethyl)pyrazin-2-amine.
What is the SMILES notation for 3-(trifluoromethyl)pyrazin-2-amine?
The canonical SMILES for 3-(trifluoromethyl)pyrazin-2-amine is Nc1nccnc1C(F)(F)F.
What is the InChIKey of 3-(trifluoromethyl)pyrazin-2-amine?
The InChIKey is GDOQHWXDKQJKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4F3N3/c6-5(7,8)3-4(9)11-2-1-10-3/h1-2H,(H2,9,11).
What are the key properties of 3-(trifluoromethyl)pyrazin-2-amine?
3-(trifluoromethyl)pyrazin-2-amine has a molecular weight of 163.10 g/mol, XLogP of 1.08, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethyl)pyrazin-2-amine is sourced from PubChem (CID 25069463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).