4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione

C10H18N2O5 — CID 115475673

IUPAC4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione
SMILESCOCCNCC(O)CN1C(=O)COCC1=O
InChIInChI=1S/C10H18N2O5/c1-16-3-2-11-4-8(13)5-12-9(14)6-17-7-10(12)15/h8,11,13H,2-7H2,1H3
InChIKeyQGXGDXZJFGGHLZ-UHFFFAOYSA-N
MW246.26 g/mol
LogP-2.03
Rot. Bonds7

About 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione

4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione (PubChem CID 115475673) has the molecular formula C10H18N2O5 and a molecular weight of 246.26 g/mol. Its IUPAC name is 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione.

Molecular Properties

Compound Name4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione
PubChem CID115475673
Molecular FormulaC10H18N2O5
Molecular Weight246.26 g/mol
Exact Mass246.12
IUPAC Name4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione
SMILESCOCCNCC(O)CN1C(=O)COCC1=O
InChIInChI=1S/C10H18N2O5/c1-16-3-2-11-4-8(13)5-12-9(14)6-17-7-10(12)15/h8,11,13H,2-7H2,1H3
InChIKeyQGXGDXZJFGGHLZ-UHFFFAOYSA-N
XLogP-2.03
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 5-2.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-[2-hydroxy-3-(2-methoxyethylamino)propyl]imidazolidine-2,4-dione
CID 115475508
1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 115475430
1-(2,6-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 78971493
5-bromo-3-[2-hydroxy-3-(2-methoxyethylamino)propyl]-2-methylpyrimidin-4-one
CID 113317725
1-fluoro-3-(2-methoxyethylamino)propan-2-ol
CID 131182194
1-(2-methoxyethylamino)butan-2-ol
CID 60885611
1-[2-hydroxy-3-(2-methoxyethylamino)propyl]pyrimidin-2-one
CID 115475514
1-(2-methoxyethylamino)-3-(4-propylpiperazin-1-yl)propan-2-ol
CID 113317417
5-chloro-1-[2-hydroxy-3-(2-methoxyethylamino)propyl]pyrimidin-2-one
CID 115475877
1-(2,2-dimethylmorpholin-4-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 113317455
1-(2-cyclopentylpyrrolidin-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 115475177
1-[2-hydroxy-3-(2-methoxyethylamino)propyl]quinolin-4-one
CID 115475683

Frequently Asked Questions

What is the IUPAC name of 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione?
The IUPAC name of 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione (CID 115475673) is 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione.
What is the SMILES notation for 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione?
The canonical SMILES for 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione is COCCNCC(O)CN1C(=O)COCC1=O.
What is the InChIKey of 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione?
The InChIKey is QGXGDXZJFGGHLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O5/c1-16-3-2-11-4-8(13)5-12-9(14)6-17-7-10(12)15/h8,11,13H,2-7H2,1H3.
What are the key properties of 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione?
4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione has a molecular weight of 246.26 g/mol, XLogP of -2.03, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydroxy-3-(2-methoxyethylamino)propyl]morpholine-3,5-dione is sourced from PubChem (CID 115475673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).