N-(2,2-difluoroethyl)pyrazin-2-amine

C6H7F2N3 — CID 79098289

IUPACN-(2,2-difluoroethyl)pyrazin-2-amine
SMILESFC(F)CNc1cnccn1
InChIInChI=1S/C6H7F2N3/c7-5(8)3-11-6-4-9-1-2-10-6/h1-2,4-5H,3H2,(H,10,11)
InChIKeyJBRCJVDGIQFLMC-UHFFFAOYSA-N
MW159.14 g/mol
LogP1.15
Rot. Bonds3

About N-(2,2-difluoroethyl)pyrazin-2-amine

N-(2,2-difluoroethyl)pyrazin-2-amine (PubChem CID 79098289) has the molecular formula C6H7F2N3 and a molecular weight of 159.14 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)pyrazin-2-amine
PubChem CID79098289
Molecular FormulaC6H7F2N3
Molecular Weight159.14 g/mol
Exact Mass159.06
IUPAC NameN-(2,2-difluoroethyl)pyrazin-2-amine
SMILESFC(F)CNc1cnccn1
InChIInChI=1S/C6H7F2N3/c7-5(8)3-11-6-4-9-1-2-10-6/h1-2,4-5H,3H2,(H,10,11)
InChIKeyJBRCJVDGIQFLMC-UHFFFAOYSA-N
XLogP1.15
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)pyrazin-2-amine?
The IUPAC name of N-(2,2-difluoroethyl)pyrazin-2-amine (CID 79098289) is N-(2,2-difluoroethyl)pyrazin-2-amine.
What is the SMILES notation for N-(2,2-difluoroethyl)pyrazin-2-amine?
The canonical SMILES for N-(2,2-difluoroethyl)pyrazin-2-amine is FC(F)CNc1cnccn1.
What is the InChIKey of N-(2,2-difluoroethyl)pyrazin-2-amine?
The InChIKey is JBRCJVDGIQFLMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F2N3/c7-5(8)3-11-6-4-9-1-2-10-6/h1-2,4-5H,3H2,(H,10,11).
What are the key properties of N-(2,2-difluoroethyl)pyrazin-2-amine?
N-(2,2-difluoroethyl)pyrazin-2-amine has a molecular weight of 159.14 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)pyrazin-2-amine is sourced from PubChem (CID 79098289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).