2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide

C21H28N2O3 — CID 86860860

IUPAC2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOCCN(CCCc1ccccc1)CC(=O)Nc1ccccc1OC
InChIInChI=1S/C21H28N2O3/c1-25-16-15-23(14-8-11-18-9-4-3-5-10-18)17-21(24)22-19-12-6-7-13-20(19)26-2/h3-7,9-10,12-13H,8,11,14-17H2,1-2H3,(H,22,24)
InChIKeyAFMXTBRSEFZFJV-UHFFFAOYSA-N
MW356.47 g/mol
LogP3.21
Rot. Bonds11

About 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide

2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 86860860) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID86860860
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Name2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOCCN(CCCc1ccccc1)CC(=O)Nc1ccccc1OC
InChIInChI=1S/C21H28N2O3/c1-25-16-15-23(14-8-11-18-9-4-3-5-10-18)17-21(24)22-19-12-6-7-13-20(19)26-2/h3-7,9-10,12-13H,8,11,14-17H2,1-2H3,(H,22,24)
InChIKeyAFMXTBRSEFZFJV-UHFFFAOYSA-N
XLogP3.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide (CID 86860860) is 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide is COCCN(CCCc1ccccc1)CC(=O)Nc1ccccc1OC.
What is the InChIKey of 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is AFMXTBRSEFZFJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-25-16-15-23(14-8-11-18-9-4-3-5-10-18)17-21(24)22-19-12-6-7-13-20(19)26-2/h3-7,9-10,12-13H,8,11,14-17H2,1-2H3,(H,22,24).
What are the key properties of 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide?
2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 356.47 g/mol, XLogP of 3.21, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(3-phenylpropyl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 86860860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).