2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide

C19H22N2O3 — CID 7867359

IUPAC2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)NCCCc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-15(22)21-17-11-5-6-12-18(17)24-14-19(23)20-13-7-10-16-8-3-2-4-9-16/h2-6,8-9,11-12H,7,10,13-14H2,1H3,(H,20,23)(H,21,22)
InChIKeyMMGZCRDGQSMLOT-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.77
Rot. Bonds8

About 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide

2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide (PubChem CID 7867359) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide
PubChem CID7867359
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)NCCCc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-15(22)21-17-11-5-6-12-18(17)24-14-19(23)20-13-7-10-16-8-3-2-4-9-16/h2-6,8-9,11-12H,7,10,13-14H2,1H3,(H,20,23)(H,21,22)
InChIKeyMMGZCRDGQSMLOT-UHFFFAOYSA-N
XLogP2.77
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.77
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-acetamidophenoxy)-N-(3-phenylpropyl)acetamide?
The IUPAC name of 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide (CID 7867359) is 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide?
The canonical SMILES for 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide is CC(=O)Nc1ccccc1OCC(=O)NCCCc1ccccc1.
What is the InChIKey of 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide?
The InChIKey is MMGZCRDGQSMLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-15(22)21-17-11-5-6-12-18(17)24-14-19(23)20-13-7-10-16-8-3-2-4-9-16/h2-6,8-9,11-12H,7,10,13-14H2,1H3,(H,20,23)(H,21,22).
What are the key properties of 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide?
2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 2.77, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidophenoxy)-N-(3-phenylpropyl)acetamide is sourced from PubChem (CID 7867359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).