(6-cyclobutyloxypyrazin-2-yl)methanamine

C9H13N3O — CID 66450566

IUPAC(6-cyclobutyloxypyrazin-2-yl)methanamine
SMILESNCc1cncc(OC2CCC2)n1
InChIInChI=1S/C9H13N3O/c10-4-7-5-11-6-9(12-7)13-8-2-1-3-8/h5-6,8H,1-4,10H2
InChIKeyONOJIYJVNZGDMU-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.87
Rot. Bonds3

About (6-cyclobutyloxypyrazin-2-yl)methanamine

(6-cyclobutyloxypyrazin-2-yl)methanamine (PubChem CID 66450566) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is (6-cyclobutyloxypyrazin-2-yl)methanamine.

Molecular Properties

Compound Name(6-cyclobutyloxypyrazin-2-yl)methanamine
PubChem CID66450566
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name(6-cyclobutyloxypyrazin-2-yl)methanamine
SMILESNCc1cncc(OC2CCC2)n1
InChIInChI=1S/C9H13N3O/c10-4-7-5-11-6-9(12-7)13-8-2-1-3-8/h5-6,8H,1-4,10H2
InChIKeyONOJIYJVNZGDMU-UHFFFAOYSA-N
XLogP0.87
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-cyclobutyloxypyrazin-2-yl)methanamine?
The IUPAC name of (6-cyclobutyloxypyrazin-2-yl)methanamine (CID 66450566) is (6-cyclobutyloxypyrazin-2-yl)methanamine.
What is the SMILES notation for (6-cyclobutyloxypyrazin-2-yl)methanamine?
The canonical SMILES for (6-cyclobutyloxypyrazin-2-yl)methanamine is NCc1cncc(OC2CCC2)n1.
What is the InChIKey of (6-cyclobutyloxypyrazin-2-yl)methanamine?
The InChIKey is ONOJIYJVNZGDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c10-4-7-5-11-6-9(12-7)13-8-2-1-3-8/h5-6,8H,1-4,10H2.
What are the key properties of (6-cyclobutyloxypyrazin-2-yl)methanamine?
(6-cyclobutyloxypyrazin-2-yl)methanamine has a molecular weight of 179.22 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclobutyloxypyrazin-2-yl)methanamine is sourced from PubChem (CID 66450566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).