N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide

C14H22N2O3 — CID 104859530

IUPACN-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)N(CCN)Cc1ccccc1
InChIInChI=1S/C14H22N2O3/c1-18-9-10-19-12-14(17)16(8-7-15)11-13-5-3-2-4-6-13/h2-6H,7-12,15H2,1H3
InChIKeyJDXGVYYDIGTFTD-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.64
Rot. Bonds9

About N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide

N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide (PubChem CID 104859530) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide
PubChem CID104859530
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)N(CCN)Cc1ccccc1
InChIInChI=1S/C14H22N2O3/c1-18-9-10-19-12-14(17)16(8-7-15)11-13-5-3-2-4-6-13/h2-6H,7-12,15H2,1H3
InChIKeyJDXGVYYDIGTFTD-UHFFFAOYSA-N
XLogP0.64
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-aminoethyl)-1-benzyl-3,3-dimethylurea
CID 79153729
2-(2-methoxyethoxy)-N-[(4-methylphenyl)methyl]-N-propylacetamide
CID 103602434
N-benzyl-2-ethoxy-N-propylacetamide
CID 60655890
N-(2-aminoethyl)-N-benzyl-4-methylpentanamide
CID 61014679
N-(2-aminoethyl)-2-ethoxy-N-(2-phenylethyl)acetamide;hydrochloride
CID 120886517
N-(2-aminoethyl)-3-methoxy-N-(2-phenylethyl)propanamide;hydrochloride
CID 120886289
2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
CID 79480179
N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
CID 79205106
[4-[[2-methoxyethyl-(2-phenylmethoxyacetyl)amino]methyl]phenyl] methanesulfonate
CID 3683870
[2-[benzyl(2-methoxyethyl)amino]-2-oxoethyl] 5-chloro-2-hydroxybenzoate
CID 9286296
(2S)-2-amino-N-benzyl-N-[2-(2-methoxyethoxy)ethyl]propanamide;hydrochloride
CID 119341269
2-[benzyl(2-methoxyethyl)amino]-2-oxoacetic acid
CID 127020353

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide (CID 104859530) is N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)N(CCN)Cc1ccccc1.
What is the InChIKey of N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide?
The InChIKey is JDXGVYYDIGTFTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-18-9-10-19-12-14(17)16(8-7-15)11-13-5-3-2-4-6-13/h2-6H,7-12,15H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide?
N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide has a molecular weight of 266.34 g/mol, XLogP of 0.64, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-benzyl-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 104859530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).