3-pyridin-2-yloxetan-3-amine

C8H10N2O — CID 67957653

IUPAC3-pyridin-2-yloxetan-3-amine
SMILESNC1(c2ccccn2)COC1
InChIInChI=1S/C8H10N2O/c9-8(5-11-6-8)7-3-1-2-4-10-7/h1-4H,5-6,9H2
InChIKeyJQBFKBADOCVRJL-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.27
Rot. Bonds1

About 3-pyridin-2-yloxetan-3-amine

3-pyridin-2-yloxetan-3-amine (PubChem CID 67957653) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-pyridin-2-yloxetan-3-amine.

Molecular Properties

Compound Name3-pyridin-2-yloxetan-3-amine
PubChem CID67957653
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-pyridin-2-yloxetan-3-amine
SMILESNC1(c2ccccn2)COC1
InChIInChI=1S/C8H10N2O/c9-8(5-11-6-8)7-3-1-2-4-10-7/h1-4H,5-6,9H2
InChIKeyJQBFKBADOCVRJL-UHFFFAOYSA-N
XLogP0.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yloxetan-3-amine?
The IUPAC name of 3-pyridin-2-yloxetan-3-amine (CID 67957653) is 3-pyridin-2-yloxetan-3-amine.
What is the SMILES notation for 3-pyridin-2-yloxetan-3-amine?
The canonical SMILES for 3-pyridin-2-yloxetan-3-amine is NC1(c2ccccn2)COC1.
What is the InChIKey of 3-pyridin-2-yloxetan-3-amine?
The InChIKey is JQBFKBADOCVRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c9-8(5-11-6-8)7-3-1-2-4-10-7/h1-4H,5-6,9H2.
What are the key properties of 3-pyridin-2-yloxetan-3-amine?
3-pyridin-2-yloxetan-3-amine has a molecular weight of 150.18 g/mol, XLogP of 0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yloxetan-3-amine is sourced from PubChem (CID 67957653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).