4-(oxan-2-ylmethyl)morpholine

C10H19NO2 — CID 91344932

IUPAC4-(oxan-2-ylmethyl)morpholine
SMILESC1CCC(CN2CCOCC2)OC1
InChIInChI=1S/C10H19NO2/c1-2-6-13-10(3-1)9-11-4-7-12-8-5-11/h10H,1-9H2
InChIKeyXSGIFIOURONEMF-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.89
Rot. Bonds2

About 4-(oxan-2-ylmethyl)morpholine

4-(oxan-2-ylmethyl)morpholine (PubChem CID 91344932) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-(oxan-2-ylmethyl)morpholine.

Molecular Properties

Compound Name4-(oxan-2-ylmethyl)morpholine
PubChem CID91344932
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name4-(oxan-2-ylmethyl)morpholine
SMILESC1CCC(CN2CCOCC2)OC1
InChIInChI=1S/C10H19NO2/c1-2-6-13-10(3-1)9-11-4-7-12-8-5-11/h10H,1-9H2
InChIKeyXSGIFIOURONEMF-UHFFFAOYSA-N
XLogP0.89
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(oxan-2-ylmethyl)morpholine?
The IUPAC name of 4-(oxan-2-ylmethyl)morpholine (CID 91344932) is 4-(oxan-2-ylmethyl)morpholine.
What is the SMILES notation for 4-(oxan-2-ylmethyl)morpholine?
The canonical SMILES for 4-(oxan-2-ylmethyl)morpholine is C1CCC(CN2CCOCC2)OC1.
What is the InChIKey of 4-(oxan-2-ylmethyl)morpholine?
The InChIKey is XSGIFIOURONEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-6-13-10(3-1)9-11-4-7-12-8-5-11/h10H,1-9H2.
What are the key properties of 4-(oxan-2-ylmethyl)morpholine?
4-(oxan-2-ylmethyl)morpholine has a molecular weight of 185.27 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxan-2-ylmethyl)morpholine is sourced from PubChem (CID 91344932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).