N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide

C8H17N3O3 — CID 79281885

IUPACN-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide
SMILESCOCCNCC(=O)N(C)CC(N)=O
InChIInChI=1S/C8H17N3O3/c1-11(6-7(9)12)8(13)5-10-3-4-14-2/h10H,3-6H2,1-2H3,(H2,9,12)
InChIKeyLAXBITBNBZREQG-UHFFFAOYSA-N
MW203.24 g/mol
LogP-1.83
Rot. Bonds7

About N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide

N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide (PubChem CID 79281885) has the molecular formula C8H17N3O3 and a molecular weight of 203.24 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide
PubChem CID79281885
Molecular FormulaC8H17N3O3
Molecular Weight203.24 g/mol
Exact Mass203.13
IUPAC NameN-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide
SMILESCOCCNCC(=O)N(C)CC(N)=O
InChIInChI=1S/C8H17N3O3/c1-11(6-7(9)12)8(13)5-10-3-4-14-2/h10H,3-6H2,1-2H3,(H2,9,12)
InChIKeyLAXBITBNBZREQG-UHFFFAOYSA-N
XLogP-1.83
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-1.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(2-methoxyethylamino)acetyl]-methylamino]propanoic acid
CID 79282817
methyl 3-[[2-(2-methoxyethylamino)acetyl]-methylamino]-2-methylpropanoate
CID 79282082
N-(3-hydroxybutyl)-2-(2-methoxyethylamino)-N-methylacetamide
CID 115740129
2-(2-methoxyethylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
CID 119677951
N-[2-[[2-[[2-[(2-amino-2-oxoethyl)-dodecylamino]-2-oxoethyl]-dodecylamino]-2-oxoethyl]-dodecylamino]-2-oxoethyl]-N-dodecyl-2-(2-methoxyethylamino)acetamide
CID 171071718
N-(cyclobutylmethyl)-2-(2-methoxyethylamino)-N-methylacetamide
CID 79282440
N-[(4-bromophenyl)methyl]-2-(2-methoxyethylamino)-N-methylacetamide
CID 78908417
N-[(4-chlorophenyl)methyl]-2-(2-methoxyethylamino)-N-methylacetamide
CID 78908421
2-methoxyethyl 2-(2-methoxyethylamino)acetate
CID 79271319
N-[(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)-N-methylacetamide;hydrochloride
CID 119683673
N-ethyl-2-[2-[2-methoxyethyl(methyl)amino]ethylamino]-N-methylacetamide
CID 62843102
2-[(2-chloroacetyl)-methylamino]acetamide
CID 19981542

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide (CID 79281885) is N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide is COCCNCC(=O)N(C)CC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide?
The InChIKey is LAXBITBNBZREQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3/c1-11(6-7(9)12)8(13)5-10-3-4-14-2/h10H,3-6H2,1-2H3,(H2,9,12).
What are the key properties of N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide?
N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide has a molecular weight of 203.24 g/mol, XLogP of -1.83, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-(2-methoxyethylamino)-N-methylacetamide is sourced from PubChem (CID 79281885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).