N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine

C10H8F3N3S — CID 162537672

IUPACN-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine
SMILESFC(F)(F)C(Nc1cnccn1)c1cccs1
InChIInChI=1S/C10H8F3N3S/c11-10(12,13)9(7-2-1-5-17-7)16-8-6-14-3-4-15-8/h1-6,9H,(H,15,16)
InChIKeyYTIJZDQPTHRBBR-UHFFFAOYSA-N
MW259.26 g/mol
LogP3.25
Rot. Bonds3

About N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine

N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine (PubChem CID 162537672) has the molecular formula C10H8F3N3S and a molecular weight of 259.26 g/mol. Its IUPAC name is N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine
PubChem CID162537672
Molecular FormulaC10H8F3N3S
Molecular Weight259.26 g/mol
Exact Mass259.04
IUPAC NameN-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine
SMILESFC(F)(F)C(Nc1cnccn1)c1cccs1
InChIInChI=1S/C10H8F3N3S/c11-10(12,13)9(7-2-1-5-17-7)16-8-6-14-3-4-15-8/h1-6,9H,(H,15,16)
InChIKeyYTIJZDQPTHRBBR-UHFFFAOYSA-N
XLogP3.25
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine?
The IUPAC name of N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine (CID 162537672) is N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine.
What is the SMILES notation for N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine?
The canonical SMILES for N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine is FC(F)(F)C(Nc1cnccn1)c1cccs1.
What is the InChIKey of N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine?
The InChIKey is YTIJZDQPTHRBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N3S/c11-10(12,13)9(7-2-1-5-17-7)16-8-6-14-3-4-15-8/h1-6,9H,(H,15,16).
What are the key properties of N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine?
N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine has a molecular weight of 259.26 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)pyrazin-2-amine is sourced from PubChem (CID 162537672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).