N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide

C11H21N3O4 — CID 3156917

IUPACN'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide
SMILESCOCCNC(=O)C(=O)NCCN1CCOCC1
InChIInChI=1S/C11H21N3O4/c1-17-7-3-13-11(16)10(15)12-2-4-14-5-8-18-9-6-14/h2-9H2,1H3,(H,12,15)(H,13,16)
InChIKeyAUEAEBBEMJMIPE-UHFFFAOYSA-N
MW259.31 g/mol
LogP-1.80
Rot. Bonds6

About N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide

N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide (PubChem CID 3156917) has the molecular formula C11H21N3O4 and a molecular weight of 259.31 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide
PubChem CID3156917
Molecular FormulaC11H21N3O4
Molecular Weight259.31 g/mol
Exact Mass259.15
IUPAC NameN'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide
SMILESCOCCNC(=O)C(=O)NCCN1CCOCC1
InChIInChI=1S/C11H21N3O4/c1-17-7-3-13-11(16)10(15)12-2-4-14-5-8-18-9-6-14/h2-9H2,1H3,(H,12,15)(H,13,16)
InChIKeyAUEAEBBEMJMIPE-UHFFFAOYSA-N
XLogP-1.80
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 5-1.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide?
The IUPAC name of N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide (CID 3156917) is N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide.
What is the SMILES notation for N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide?
The canonical SMILES for N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide is COCCNC(=O)C(=O)NCCN1CCOCC1.
What is the InChIKey of N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide?
The InChIKey is AUEAEBBEMJMIPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O4/c1-17-7-3-13-11(16)10(15)12-2-4-14-5-8-18-9-6-14/h2-9H2,1H3,(H,12,15)(H,13,16).
What are the key properties of N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide?
N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide has a molecular weight of 259.31 g/mol, XLogP of -1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-N-(2-morpholin-4-ylethyl)oxamide is sourced from PubChem (CID 3156917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).