8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

C7H7F2N5O — CID 129216704

IUPAC8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESNc1nc2c(OCC(F)F)nccn2n1
InChIInChI=1S/C7H7F2N5O/c8-4(9)3-15-6-5-12-7(10)13-14(5)2-1-11-6/h1-2,4H,3H2,(H2,10,13)
InChIKeyMYMYPGIKEVRYOM-UHFFFAOYSA-N
MW215.16 g/mol
LogP0.35
Rot. Bonds3

About 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (PubChem CID 129216704) has the molecular formula C7H7F2N5O and a molecular weight of 215.16 g/mol. Its IUPAC name is 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.

Molecular Properties

Compound Name8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
PubChem CID129216704
Molecular FormulaC7H7F2N5O
Molecular Weight215.16 g/mol
Exact Mass215.06
IUPAC Name8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESNc1nc2c(OCC(F)F)nccn2n1
InChIInChI=1S/C7H7F2N5O/c8-4(9)3-15-6-5-12-7(10)13-14(5)2-1-11-6/h1-2,4H,3H2,(H2,10,13)
InChIKeyMYMYPGIKEVRYOM-UHFFFAOYSA-N
XLogP0.35
TPSA78.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.16
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The IUPAC name of 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (CID 129216704) is 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.
What is the SMILES notation for 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The canonical SMILES for 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is Nc1nc2c(OCC(F)F)nccn2n1.
What is the InChIKey of 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The InChIKey is MYMYPGIKEVRYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2N5O/c8-4(9)3-15-6-5-12-7(10)13-14(5)2-1-11-6/h1-2,4H,3H2,(H2,10,13).
What are the key properties of 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine has a molecular weight of 215.16 g/mol, XLogP of 0.35, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,2-difluoroethoxy)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is sourced from PubChem (CID 129216704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).