1-(2,6-dimethylmorpholin-4-yl)ethanone

C8H15NO2 — CID 3361054

IUPAC1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C8H15NO2/c1-6-4-9(8(3)10)5-7(2)11-6/h6-7H,4-5H2,1-3H3
InChIKeyITBIIJTXOBWJPI-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.64
Rot. Bonds

About 1-(2,6-dimethylmorpholin-4-yl)ethanone

1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 3361054) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID3361054
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C8H15NO2/c1-6-4-9(8(3)10)5-7(2)11-6/h6-7H,4-5H2,1-3H3
InChIKeyITBIIJTXOBWJPI-UHFFFAOYSA-N
XLogP0.64
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,7-dimethyl-1,4-oxazepan-4-yl)ethanone
CID 146290513
1-(2,6-dimethylmorpholin-4-yl)propane-1,2-dione
CID 131176238
(2S,6S)-2,6-dimethylmorpholine-4-carboxylic acid
CID 137442866
2,6-dimethylmorpholine-4-carboxylic acid
CID 22047773
2,6-dimethylmorpholine-4-carbonyl chloride
CID 19080228
1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-methylbut-2-en-1-one
CID 52520989
ethane;1-(3-methylazetidin-1-yl)ethanone
CID 143998304
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-pyrrolidin-1-ylmethanone
CID 103931869
2-bromo-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanone
CID 53216148
[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]sulfanium
CID 153278899
(2S)-2-bromo-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propan-1-one
CID 124552619
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 3361054) is 1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)ethanone is CC(=O)N1CC(C)OC(C)C1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is ITBIIJTXOBWJPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6-4-9(8(3)10)5-7(2)11-6/h6-7H,4-5H2,1-3H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)ethanone?
1-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 157.21 g/mol, XLogP of 0.64, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 3361054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).