5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine

C9H14N4O — CID 131010493

IUPAC5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine
SMILESCCOC1CN(c2cnc(N)cn2)C1
InChIInChI=1S/C9H14N4O/c1-2-14-7-5-13(6-7)9-4-11-8(10)3-12-9/h3-4,7H,2,5-6H2,1H3,(H2,10,11)
InChIKeyAKSVFXMUMJGFOP-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.28
Rot. Bonds3

About 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine

5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine (PubChem CID 131010493) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine.

Molecular Properties

Compound Name5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine
PubChem CID131010493
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine
SMILESCCOC1CN(c2cnc(N)cn2)C1
InChIInChI=1S/C9H14N4O/c1-2-14-7-5-13(6-7)9-4-11-8(10)3-12-9/h3-4,7H,2,5-6H2,1H3,(H2,10,11)
InChIKeyAKSVFXMUMJGFOP-UHFFFAOYSA-N
XLogP0.28
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine?
The IUPAC name of 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine (CID 131010493) is 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine.
What is the SMILES notation for 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine?
The canonical SMILES for 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine is CCOC1CN(c2cnc(N)cn2)C1.
What is the InChIKey of 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine?
The InChIKey is AKSVFXMUMJGFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-2-14-7-5-13(6-7)9-4-11-8(10)3-12-9/h3-4,7H,2,5-6H2,1H3,(H2,10,11).
What are the key properties of 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine?
5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine has a molecular weight of 194.24 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethoxyazetidin-1-yl)pyrazin-2-amine is sourced from PubChem (CID 131010493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).