2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide

C19H24N2O3 — CID 119777851

IUPAC2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide
SMILESCOCCNCC(=O)NCc1ccccc1Oc1cccc(C)c1
InChIInChI=1S/C19H24N2O3/c1-15-6-5-8-17(12-15)24-18-9-4-3-7-16(18)13-21-19(22)14-20-10-11-23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22)
InChIKeySTDGEABELVBWLO-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.64
Rot. Bonds9

About 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide

2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide (PubChem CID 119777851) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide
PubChem CID119777851
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide
SMILESCOCCNCC(=O)NCc1ccccc1Oc1cccc(C)c1
InChIInChI=1S/C19H24N2O3/c1-15-6-5-8-17(12-15)24-18-9-4-3-7-16(18)13-21-19(22)14-20-10-11-23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22)
InChIKeySTDGEABELVBWLO-UHFFFAOYSA-N
XLogP2.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.64
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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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide (CID 119777851) is 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide is COCCNCC(=O)NCc1ccccc1Oc1cccc(C)c1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide?
The InChIKey is STDGEABELVBWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-15-6-5-8-17(12-15)24-18-9-4-3-7-16(18)13-21-19(22)14-20-10-11-23-2/h3-9,12,20H,10-11,13-14H2,1-2H3,(H,21,22).
What are the key properties of 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide?
2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide has a molecular weight of 328.41 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 119777851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).