2-morpholin-3-yl-1-(oxan-3-yl)ethanone

C11H19NO3 — CID 107138449

IUPAC2-morpholin-3-yl-1-(oxan-3-yl)ethanone
SMILESO=C(CC1COCCN1)C1CCCOC1
InChIInChI=1S/C11H19NO3/c13-11(9-2-1-4-14-7-9)6-10-8-15-5-3-12-10/h9-10,12H,1-8H2
InChIKeyAMAXUEHUOLRLAA-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.36
Rot. Bonds3

About 2-morpholin-3-yl-1-(oxan-3-yl)ethanone

2-morpholin-3-yl-1-(oxan-3-yl)ethanone (PubChem CID 107138449) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-morpholin-3-yl-1-(oxan-3-yl)ethanone.

Molecular Properties

Compound Name2-morpholin-3-yl-1-(oxan-3-yl)ethanone
PubChem CID107138449
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-morpholin-3-yl-1-(oxan-3-yl)ethanone
SMILESO=C(CC1COCCN1)C1CCCOC1
InChIInChI=1S/C11H19NO3/c13-11(9-2-1-4-14-7-9)6-10-8-15-5-3-12-10/h9-10,12H,1-8H2
InChIKeyAMAXUEHUOLRLAA-UHFFFAOYSA-N
XLogP0.36
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-1-(oxan-3-yl)ethanone?
The IUPAC name of 2-morpholin-3-yl-1-(oxan-3-yl)ethanone (CID 107138449) is 2-morpholin-3-yl-1-(oxan-3-yl)ethanone.
What is the SMILES notation for 2-morpholin-3-yl-1-(oxan-3-yl)ethanone?
The canonical SMILES for 2-morpholin-3-yl-1-(oxan-3-yl)ethanone is O=C(CC1COCCN1)C1CCCOC1.
What is the InChIKey of 2-morpholin-3-yl-1-(oxan-3-yl)ethanone?
The InChIKey is AMAXUEHUOLRLAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c13-11(9-2-1-4-14-7-9)6-10-8-15-5-3-12-10/h9-10,12H,1-8H2.
What are the key properties of 2-morpholin-3-yl-1-(oxan-3-yl)ethanone?
2-morpholin-3-yl-1-(oxan-3-yl)ethanone has a molecular weight of 213.28 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-1-(oxan-3-yl)ethanone is sourced from PubChem (CID 107138449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).