1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone

C11H20N2O4 — CID 81202847

IUPAC1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone
SMILESO=C(CC1COCCN1)N1CCOC(CO)C1
InChIInChI=1S/C11H20N2O4/c14-7-10-6-13(2-4-17-10)11(15)5-9-8-16-3-1-12-9/h9-10,12,14H,1-8H2
InChIKeyZGMHLIYUYLAGAG-UHFFFAOYSA-N
MW244.29 g/mol
LogP-1.42
Rot. Bonds3

About 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone

1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone (PubChem CID 81202847) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone.

Molecular Properties

Compound Name1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone
PubChem CID81202847
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Name1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone
SMILESO=C(CC1COCCN1)N1CCOC(CO)C1
InChIInChI=1S/C11H20N2O4/c14-7-10-6-13(2-4-17-10)11(15)5-9-8-16-3-1-12-9/h9-10,12,14H,1-8H2
InChIKeyZGMHLIYUYLAGAG-UHFFFAOYSA-N
XLogP-1.42
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-1.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-hydroxyazetidin-1-yl)-2-morpholin-3-ylethanone
CID 107217537
1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyrrolidin-3-ylethanone
CID 81203465
2-bromo-1-[2-(hydroxymethyl)morpholin-4-yl]ethanone
CID 81203713
[2-(hydroxymethyl)morpholin-4-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone;hydrochloride
CID 120932154
cyclopropyl-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81208707
1-(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-2-morpholin-3-ylethanone
CID 81102917
1-[2-(hydroxymethyl)morpholin-4-yl]-2-methoxyethanone
CID 81208943
1-[2-(hydroxymethyl)morpholin-4-yl]-2-propoxyethanone
CID 103804092
1-[(3R)-3-methylmorpholin-4-yl]-2-morpholin-3-ylethanone
CID 106774293
[2-(hydroxymethyl)morpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 119322366
N-methyl-4-(2-morpholin-3-ylacetyl)morpholine-3-carboxamide
CID 83099010
[2-(hydroxymethyl)morpholin-4-yl]-(2-methylcyclopropyl)methanone
CID 81208013

Frequently Asked Questions

What is the IUPAC name of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone?
The IUPAC name of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone (CID 81202847) is 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone.
What is the SMILES notation for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone?
The canonical SMILES for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone is O=C(CC1COCCN1)N1CCOC(CO)C1.
What is the InChIKey of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone?
The InChIKey is ZGMHLIYUYLAGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c14-7-10-6-13(2-4-17-10)11(15)5-9-8-16-3-1-12-9/h9-10,12,14H,1-8H2.
What are the key properties of 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone?
1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone has a molecular weight of 244.29 g/mol, XLogP of -1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(hydroxymethyl)morpholin-4-yl]-2-morpholin-3-ylethanone is sourced from PubChem (CID 81202847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).