3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

C8H11F3N4 — CID 62673035

IUPAC3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESCN(CC(F)(F)F)c1nccnc1CN
InChIInChI=1S/C8H11F3N4/c1-15(5-8(9,10)11)7-6(4-12)13-2-3-14-7/h2-3H,4-5,12H2,1H3
InChIKeyJYOXYIJPJDNAJA-UHFFFAOYSA-N
MW220.20 g/mol
LogP0.93
Rot. Bonds3

About 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine

3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (PubChem CID 62673035) has the molecular formula C8H11F3N4 and a molecular weight of 220.20 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
PubChem CID62673035
Molecular FormulaC8H11F3N4
Molecular Weight220.20 g/mol
Exact Mass220.09
IUPAC Name3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
SMILESCN(CC(F)(F)F)c1nccnc1CN
InChIInChI=1S/C8H11F3N4/c1-15(5-8(9,10)11)7-6(4-12)13-2-3-14-7/h2-3H,4-5,12H2,1H3
InChIKeyJYOXYIJPJDNAJA-UHFFFAOYSA-N
XLogP0.93
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine (CID 62673035) is 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is CN(CC(F)(F)F)c1nccnc1CN.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
The InChIKey is JYOXYIJPJDNAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4/c1-15(5-8(9,10)11)7-6(4-12)13-2-3-14-7/h2-3H,4-5,12H2,1H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine?
3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine has a molecular weight of 220.20 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine is sourced from PubChem (CID 62673035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).