2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide

C17H22N2O2 — CID 119722532

IUPAC2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide
SMILESCOCCNCC(=O)NCCc1cccc2ccccc12
InChIInChI=1S/C17H22N2O2/c1-21-12-11-18-13-17(20)19-10-9-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,18H,9-13H2,1H3,(H,19,20)
InChIKeyXLKVABXOUOMCEB-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.73
Rot. Bonds8

About 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide

2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide (PubChem CID 119722532) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide
PubChem CID119722532
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide
SMILESCOCCNCC(=O)NCCc1cccc2ccccc12
InChIInChI=1S/C17H22N2O2/c1-21-12-11-18-13-17(20)19-10-9-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,18H,9-13H2,1H3,(H,19,20)
InChIKeyXLKVABXOUOMCEB-UHFFFAOYSA-N
XLogP1.73
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.73
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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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide (CID 119722532) is 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide is COCCNCC(=O)NCCc1cccc2ccccc12.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide?
The InChIKey is XLKVABXOUOMCEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-21-12-11-18-13-17(20)19-10-9-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,18H,9-13H2,1H3,(H,19,20).
What are the key properties of 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide?
2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide has a molecular weight of 286.38 g/mol, XLogP of 1.73, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(2-naphthalen-1-ylethyl)acetamide is sourced from PubChem (CID 119722532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).