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

C8H10F3N3 — CID 163382775

IUPACN-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(C(F)(F)F)cn1
InChIInChI=1S/C8H10F3N3/c1-2-12-3-6-4-14-7(5-13-6)8(9,10)11/h4-5,12H,2-3H2,1H3
InChIKeyUUQAQCUPAXCNPG-UHFFFAOYSA-N
MW205.18 g/mol
LogP1.60
Rot. Bonds3

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

N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine (PubChem CID 163382775) has the molecular formula C8H10F3N3 and a molecular weight of 205.18 g/mol. Its IUPAC name is N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine
PubChem CID163382775
Molecular FormulaC8H10F3N3
Molecular Weight205.18 g/mol
Exact Mass205.08
IUPAC NameN-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(C(F)(F)F)cn1
InChIInChI=1S/C8H10F3N3/c1-2-12-3-6-4-14-7(5-13-6)8(9,10)11/h4-5,12H,2-3H2,1H3
InChIKeyUUQAQCUPAXCNPG-UHFFFAOYSA-N
XLogP1.60
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(Pyrazin-2-yl)methanamine
CID 266781
Methyl[1-(pyrazin-2-yl)ethyl]amine
CID 60818558
1-[[6-(1,4,8,11-Tetrazacyclotetradec-1-ylmethyl)pyrazin-2-yl]methyl]-1,4,8,11-tetrazacyclotetradecane;hydrobromide
CID 49859983
2-(Aminomethyl)-5-methylpyrazine
CID 2756496
Pyrazin-2-ylmethanamine hydrochloride
CID 21265794
N-methyl-1-(pyrazin-2-yl)methanamine
CID 16762521
2-((Piperazin-1-yl)methyl)pyrazine
CID 43439447
2-Methyl-5-(trifluoromethyl)pyrazine
CID 45790699
6-Methyl-2-pyrazinemethanamine
CID 66661136
(5-Methylpyrazin-2-yl)methanamine dihydrochloride
CID 121397354
1-[[6-(1,4,8,11-Tetrazacyclotetradec-1-ylmethyl)pyrazin-2-yl]methyl]-1,4,8,11-tetrazacyclotetradecane
CID 464165
1-[[5-(1,4,8,11-Tetrazacyclotetradec-1-ylmethyl)pyrazin-2-yl]methyl]-1,4,8,11-tetrazacyclotetradecane
CID 464166

Frequently Asked Questions

What is the IUPAC name of N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine (CID 163382775) is N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine is CCNCc1cnc(C(F)(F)F)cn1.
What is the InChIKey of N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine?
The InChIKey is UUQAQCUPAXCNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3/c1-2-12-3-6-4-14-7(5-13-6)8(9,10)11/h4-5,12H,2-3H2,1H3.
What are the key properties of N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine?
N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine has a molecular weight of 205.18 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(trifluoromethyl)pyrazin-2-yl]methyl]ethanamine is sourced from PubChem (CID 163382775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).