N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine

C8H10F3N3 — CID 174220407

IUPACN-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine
SMILESCNC(C)c1cnc(C(F)(F)F)cn1
InChIInChI=1S/C8H10F3N3/c1-5(12-2)6-3-14-7(4-13-6)8(9,10)11/h3-5,12H,1-2H3
InChIKeyMGOZAZKZNIYUGX-UHFFFAOYSA-N
MW205.18 g/mol
LogP1.78
Rot. Bonds2

About N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine

N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine (PubChem CID 174220407) has the molecular formula C8H10F3N3 and a molecular weight of 205.18 g/mol. Its IUPAC name is N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine
PubChem CID174220407
Molecular FormulaC8H10F3N3
Molecular Weight205.18 g/mol
Exact Mass205.08
IUPAC NameN-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine
SMILESCNC(C)c1cnc(C(F)(F)F)cn1
InChIInChI=1S/C8H10F3N3/c1-5(12-2)6-3-14-7(4-13-6)8(9,10)11/h3-5,12H,1-2H3
InChIKeyMGOZAZKZNIYUGX-UHFFFAOYSA-N
XLogP1.78
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine?
The IUPAC name of N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine (CID 174220407) is N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine.
What is the SMILES notation for N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine?
The canonical SMILES for N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine is CNC(C)c1cnc(C(F)(F)F)cn1.
What is the InChIKey of N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine?
The InChIKey is MGOZAZKZNIYUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3/c1-5(12-2)6-3-14-7(4-13-6)8(9,10)11/h3-5,12H,1-2H3.
What are the key properties of N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine?
N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine has a molecular weight of 205.18 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(trifluoromethyl)pyrazin-2-yl]ethanamine is sourced from PubChem (CID 174220407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).