2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide

C17H20N2O2 — CID 79480179

IUPAC2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
SMILESNCCOCC(=O)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c18-11-12-21-14-17(20)19(16-9-5-2-6-10-16)13-15-7-3-1-4-8-15/h1-10H,11-14,18H2
InChIKeySONWYFAIFZHHKG-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.20
Rot. Bonds7

About 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide

2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide (PubChem CID 79480179) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
PubChem CID79480179
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide
SMILESNCCOCC(=O)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c18-11-12-21-14-17(20)19(16-9-5-2-6-10-16)13-15-7-3-1-4-8-15/h1-10H,11-14,18H2
InChIKeySONWYFAIFZHHKG-UHFFFAOYSA-N
XLogP2.20
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
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-aminoethoxy)-N-benzyl-N-phenylacetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide (CID 79480179) is 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide is NCCOCC(=O)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide?
The InChIKey is SONWYFAIFZHHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c18-11-12-21-14-17(20)19(16-9-5-2-6-10-16)13-15-7-3-1-4-8-15/h1-10H,11-14,18H2.
What are the key properties of 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide?
2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide has a molecular weight of 284.36 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-benzyl-N-phenylacetamide is sourced from PubChem (CID 79480179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).