3-pyridin-2-ylmorpholine

C9H12N2O — CID 54247101

IUPAC3-pyridin-2-ylmorpholine
SMILESc1ccc(C2COCCN2)nc1
InChIInChI=1S/C9H12N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-4,9,11H,5-7H2
InChIKeyDVUOZCFMRLDACP-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.74
Rot. Bonds1

About 3-pyridin-2-ylmorpholine

3-pyridin-2-ylmorpholine (PubChem CID 54247101) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 3-pyridin-2-ylmorpholine.

Molecular Properties

Compound Name3-pyridin-2-ylmorpholine
PubChem CID54247101
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name3-pyridin-2-ylmorpholine
SMILESc1ccc(C2COCCN2)nc1
InChIInChI=1S/C9H12N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-4,9,11H,5-7H2
InChIKeyDVUOZCFMRLDACP-UHFFFAOYSA-N
XLogP0.74
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-ylmorpholine?
The IUPAC name of 3-pyridin-2-ylmorpholine (CID 54247101) is 3-pyridin-2-ylmorpholine.
What is the SMILES notation for 3-pyridin-2-ylmorpholine?
The canonical SMILES for 3-pyridin-2-ylmorpholine is c1ccc(C2COCCN2)nc1.
What is the InChIKey of 3-pyridin-2-ylmorpholine?
The InChIKey is DVUOZCFMRLDACP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-4,9,11H,5-7H2.
What are the key properties of 3-pyridin-2-ylmorpholine?
3-pyridin-2-ylmorpholine has a molecular weight of 164.21 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-ylmorpholine is sourced from PubChem (CID 54247101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).