1,1-dimethoxyethane;1-morpholin-4-ylethanone

C10H21NO4 — CID 70453276

IUPAC1,1-dimethoxyethane;1-morpholin-4-ylethanone
SMILESCC(=O)N1CCOCC1.COC(C)OC
InChIInChI=1S/C6H11NO2.C4H10O2/c1-6(8)7-2-4-9-5-3-7;1-4(5-2)6-3/h2-5H2,1H3;4H,1-3H3
InChIKeyUHKJAYDABZACOC-UHFFFAOYSA-N
MW219.28 g/mol
LogP0.49
Rot. Bonds2

About 1,1-dimethoxyethane;1-morpholin-4-ylethanone

1,1-dimethoxyethane;1-morpholin-4-ylethanone (PubChem CID 70453276) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 1,1-dimethoxyethane;1-morpholin-4-ylethanone.

Molecular Properties

Compound Name1,1-dimethoxyethane;1-morpholin-4-ylethanone
PubChem CID70453276
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name1,1-dimethoxyethane;1-morpholin-4-ylethanone
SMILESCC(=O)N1CCOCC1.COC(C)OC
InChIInChI=1S/C6H11NO2.C4H10O2/c1-6(8)7-2-4-9-5-3-7;1-4(5-2)6-3/h2-5H2,1H3;4H,1-3H3
InChIKeyUHKJAYDABZACOC-UHFFFAOYSA-N
XLogP0.49
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-(3,3-Diethoxypropyl)morpholin-3-one
CID 79467738
2,2-Diethoxy-1-morpholin-4-ylethanone
CID 155929531
3,3-Dimethoxy-1-morpholinopropan-1-one
CID 129753021
N-(dimethoxyacetyl)morpholine
CID 21298597
1-[(2S)-2-[(2-methylpropan-2-yl)oxy]morpholin-4-yl]ethanone
CID 58469377
4-(2,2-Dimethoxyethyl)-1-methylpiperazin-2-one
CID 66222147
1-[2-[(2-Methylpropan-2-yl)oxy]morpholin-4-yl]ethanone
CID 67135372
(1-Acetyloxy-2-morpholin-4-ylethyl) acetate
CID 67265675
1-[(2R)-2-ethoxymorpholin-4-yl]-3-methoxypropan-1-one
CID 68221110
1-[(2R)-2-ethoxymorpholin-4-yl]ethanone
CID 68221720
1-Methoxyethyl 2-morpholin-4-ylethyl carbonate
CID 69603043
1-(4-Ethylmorpholin-4-ium-4-yl)ethanone
CID 71330424

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethoxyethane;1-morpholin-4-ylethanone?
The IUPAC name of 1,1-dimethoxyethane;1-morpholin-4-ylethanone (CID 70453276) is 1,1-dimethoxyethane;1-morpholin-4-ylethanone.
What is the SMILES notation for 1,1-dimethoxyethane;1-morpholin-4-ylethanone?
The canonical SMILES for 1,1-dimethoxyethane;1-morpholin-4-ylethanone is CC(=O)N1CCOCC1.COC(C)OC.
What is the InChIKey of 1,1-dimethoxyethane;1-morpholin-4-ylethanone?
The InChIKey is UHKJAYDABZACOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2.C4H10O2/c1-6(8)7-2-4-9-5-3-7;1-4(5-2)6-3/h2-5H2,1H3;4H,1-3H3.
What are the key properties of 1,1-dimethoxyethane;1-morpholin-4-ylethanone?
1,1-dimethoxyethane;1-morpholin-4-ylethanone has a molecular weight of 219.28 g/mol, XLogP of 0.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethoxyethane;1-morpholin-4-ylethanone is sourced from PubChem (CID 70453276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).