1-(5-ethoxypyrazin-2-yl)ethanamine

C8H13N3O — CID 118255855

IUPAC1-(5-ethoxypyrazin-2-yl)ethanamine
SMILESCCOc1cnc(C(C)N)cn1
InChIInChI=1S/C8H13N3O/c1-3-12-8-5-10-7(4-11-8)6(2)9/h4-6H,3,9H2,1-2H3
InChIKeyQOTNUCIXIAYZPY-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.89
Rot. Bonds3

About 1-(5-ethoxypyrazin-2-yl)ethanamine

1-(5-ethoxypyrazin-2-yl)ethanamine (PubChem CID 118255855) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-(5-ethoxypyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(5-ethoxypyrazin-2-yl)ethanamine
PubChem CID118255855
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name1-(5-ethoxypyrazin-2-yl)ethanamine
SMILESCCOc1cnc(C(C)N)cn1
InChIInChI=1S/C8H13N3O/c1-3-12-8-5-10-7(4-11-8)6(2)9/h4-6H,3,9H2,1-2H3
InChIKeyQOTNUCIXIAYZPY-UHFFFAOYSA-N
XLogP0.89
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethoxypyrazin-2-yl)ethanamine?
The IUPAC name of 1-(5-ethoxypyrazin-2-yl)ethanamine (CID 118255855) is 1-(5-ethoxypyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-(5-ethoxypyrazin-2-yl)ethanamine?
The canonical SMILES for 1-(5-ethoxypyrazin-2-yl)ethanamine is CCOc1cnc(C(C)N)cn1.
What is the InChIKey of 1-(5-ethoxypyrazin-2-yl)ethanamine?
The InChIKey is QOTNUCIXIAYZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-3-12-8-5-10-7(4-11-8)6(2)9/h4-6H,3,9H2,1-2H3.
What are the key properties of 1-(5-ethoxypyrazin-2-yl)ethanamine?
1-(5-ethoxypyrazin-2-yl)ethanamine has a molecular weight of 167.21 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethoxypyrazin-2-yl)ethanamine is sourced from PubChem (CID 118255855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).