2-(benzylamino)-N-(2-methoxyethyl)acetamide

C12H18N2O2 — CID 54813572

IUPAC2-(benzylamino)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNCc1ccccc1
InChIInChI=1S/C12H18N2O2/c1-16-8-7-14-12(15)10-13-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15)
InChIKeyWCEYKBNZOJMZNG-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.54
Rot. Bonds7

About 2-(benzylamino)-N-(2-methoxyethyl)acetamide

2-(benzylamino)-N-(2-methoxyethyl)acetamide (PubChem CID 54813572) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-(benzylamino)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(benzylamino)-N-(2-methoxyethyl)acetamide
PubChem CID54813572
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-(benzylamino)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNCc1ccccc1
InChIInChI=1S/C12H18N2O2/c1-16-8-7-14-12(15)10-13-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15)
InChIKeyWCEYKBNZOJMZNG-UHFFFAOYSA-N
XLogP0.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[[[2-(2-methoxyethylamino)-2-oxoethyl]amino]methyl]phenyl]acetic acid
CID 103263896
N-(2-methoxyethyl)-2-[(4-nitrophenyl)methylamino]acetamide
CID 60691812
2-[(3,5-dichlorophenyl)methylamino]-N-(2-methoxyethyl)acetamide
CID 112685455
N-benzyl-4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]benzamide
CID 54844190
N-(2-methoxyethyl)-2-[[4-(trifluoromethylsulfanyl)phenyl]methylamino]acetamide
CID 115575340
2-[(3-bromo-4-methylphenyl)methylamino]-N-(2-methoxyethyl)acetamide
CID 115875961
N-(2-methoxyethyl)-2-(3-phenylprop-2-ynylamino)acetamide
CID 113405112
2-[[3-(methoxymethyl)phenyl]methylamino]-N-(3-methoxypropyl)acetamide
CID 61486434
2-[[3-(hydroxymethyl)phenyl]methylamino]-N-(3-methoxypropyl)acetamide
CID 107230510
2-(2,3-dihydro-1H-inden-5-ylmethylamino)-N-(2-methoxyethyl)acetamide
CID 112695615
N-(2-methoxyethyl)-2-[(1-propylpyrrol-2-yl)methylamino]acetamide
CID 113405048
2-[(3-bromo-4-chlorophenyl)methylamino]-N-(2-methoxyethyl)acetamide
CID 112555040

Frequently Asked Questions

What is the IUPAC name of 2-(benzylamino)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(benzylamino)-N-(2-methoxyethyl)acetamide (CID 54813572) is 2-(benzylamino)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(benzylamino)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(benzylamino)-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNCc1ccccc1.
What is the InChIKey of 2-(benzylamino)-N-(2-methoxyethyl)acetamide?
The InChIKey is WCEYKBNZOJMZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-16-8-7-14-12(15)10-13-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15).
What are the key properties of 2-(benzylamino)-N-(2-methoxyethyl)acetamide?
2-(benzylamino)-N-(2-methoxyethyl)acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzylamino)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 54813572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).