N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide

C13H28N4O5 — CID 123372853

IUPACN-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide
SMILESCNCCNC(=O)NCCOCCOCC(=O)NCCOC
InChIInChI=1S/C13H28N4O5/c1-14-3-4-16-13(19)17-6-8-21-9-10-22-11-12(18)15-5-7-20-2/h14H,3-11H2,1-2H3,(H,15,18)(H2,16,17,19)
InChIKeyXJWUXLDIOOVDRL-UHFFFAOYSA-N
MW320.39 g/mol
LogP-1.70
Rot. Bonds14

About N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide

N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide (PubChem CID 123372853) has the molecular formula C13H28N4O5 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide
PubChem CID123372853
Molecular FormulaC13H28N4O5
Molecular Weight320.39 g/mol
Exact Mass320.21
IUPAC NameN-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide
SMILESCNCCNC(=O)NCCOCCOCC(=O)NCCOC
InChIInChI=1S/C13H28N4O5/c1-14-3-4-16-13(19)17-6-8-21-9-10-22-11-12(18)15-5-7-20-2/h14H,3-11H2,1-2H3,(H,15,18)(H2,16,17,19)
InChIKeyXJWUXLDIOOVDRL-UHFFFAOYSA-N
XLogP-1.70
TPSA109.95 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 5-1.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethoxy)-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]acetamide
CID 175629817
2-[2-[2-(methylamino)ethoxy]ethoxy]-N-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethyl]acetamide
CID 59533808
2-[2-[[2-(2-methoxyethoxy)acetyl]amino]ethoxy]acetamide
CID 103767893
N-(2-methoxyethyl)-3-(methylamino)propanamide
CID 43827811
ethane;2-ethoxy-N-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 142043663
2-(2-methoxyethoxy)-N-(3-methoxypropyl)acetamide
CID 103601588
N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]-2-[2-[2-(methylamino)ethoxy]ethoxy]acetamide
CID 123667701
ethane;3-(4-methoxybutoxy)-N-[2-(methylamino)ethyl]propanamide
CID 153398683
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327
ethane;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylethanamine
CID 163400177
2-[2-[2-[[2-(2-ethoxyethoxy)acetyl]amino]ethoxy]ethoxy]-N-methylacetamide
CID 139325518
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155715449

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide (CID 123372853) is N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide is CNCCNC(=O)NCCOCCOCC(=O)NCCOC.
What is the InChIKey of N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide?
The InChIKey is XJWUXLDIOOVDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4O5/c1-14-3-4-16-13(19)17-6-8-21-9-10-22-11-12(18)15-5-7-20-2/h14H,3-11H2,1-2H3,(H,15,18)(H2,16,17,19).
What are the key properties of N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide?
N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide has a molecular weight of 320.39 g/mol, XLogP of -1.70, 14 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[2-[2-[2-(methylamino)ethylcarbamoylamino]ethoxy]ethoxy]acetamide is sourced from PubChem (CID 123372853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).