1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone

C11H19NO4 — CID 170446528

IUPAC1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone
SMILESO=C(COC1CCCCO1)N1CCOCC1
InChIInChI=1S/C11H19NO4/c13-10(12-4-7-14-8-5-12)9-16-11-3-1-2-6-15-11/h11H,1-9H2
InChIKeyHSFFEXBEBUOSRN-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.39
Rot. Bonds3

About 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone

1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone (PubChem CID 170446528) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone
PubChem CID170446528
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone
SMILESO=C(COC1CCCCO1)N1CCOCC1
InChIInChI=1S/C11H19NO4/c13-10(12-4-7-14-8-5-12)9-16-11-3-1-2-6-15-11/h11H,1-9H2
InChIKeyHSFFEXBEBUOSRN-UHFFFAOYSA-N
XLogP0.39
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone (CID 170446528) is 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone is O=C(COC1CCCCO1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone?
The InChIKey is HSFFEXBEBUOSRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c13-10(12-4-7-14-8-5-12)9-16-11-3-1-2-6-15-11/h11H,1-9H2.
What are the key properties of 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone?
1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone has a molecular weight of 229.28 g/mol, XLogP of 0.39, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(oxan-2-yloxy)ethanone is sourced from PubChem (CID 170446528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).