2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide

C20H26N2O2 — CID 109000620

IUPAC2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide
SMILESCOc1ccccc1CCNCC(=O)NCCCc1ccccc1
InChIInChI=1S/C20H26N2O2/c1-24-19-12-6-5-11-18(19)13-15-21-16-20(23)22-14-7-10-17-8-3-2-4-9-17/h2-6,8-9,11-12,21H,7,10,13-16H2,1H3,(H,22,23)
InChIKeyGEBDHYCHSWMBOT-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.58
Rot. Bonds10

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

2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide (PubChem CID 109000620) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide
PubChem CID109000620
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide
SMILESCOc1ccccc1CCNCC(=O)NCCCc1ccccc1
InChIInChI=1S/C20H26N2O2/c1-24-19-12-6-5-11-18(19)13-15-21-16-20(23)22-14-7-10-17-8-3-2-4-9-17/h2-6,8-9,11-12,21H,7,10,13-16H2,1H3,(H,22,23)
InChIKeyGEBDHYCHSWMBOT-UHFFFAOYSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.58
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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Related Compounds

2-[2-(4-chlorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 109000751
2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 109000124
2-(ethylamino)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113219093
N-[2-(2-methoxyphenyl)ethyl]-4-phenylbutan-1-amine
CID 106261219
N-[(4-chlorophenyl)methyl]-2-[2-(2-methoxyphenyl)ethylamino]acetamide
CID 108998211
N-[2-(2-methoxyphenyl)ethyl]-5-phenylpentan-1-amine
CID 18790238
2-(2-hydroxyethylamino)-N-(3-phenylpropyl)acetamide
CID 163571162
2-[acetyl(3-phenylpropyl)amino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113165813
2-[(2-chlorophenyl)methylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 108997926
2-[(2-fluorophenyl)methylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 108997498
N-[2-(cyclohexen-1-yl)ethyl]-2-[2-(2-methoxyphenyl)ethylamino]acetamide
CID 108993930
2-amino-N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]acetamide
CID 103629773

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide?
The IUPAC name of 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide (CID 109000620) is 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide.
What is the SMILES notation for 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide?
The canonical SMILES for 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide is COc1ccccc1CCNCC(=O)NCCCc1ccccc1.
What is the InChIKey of 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide?
The InChIKey is GEBDHYCHSWMBOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-24-19-12-6-5-11-18(19)13-15-21-16-20(23)22-14-7-10-17-8-3-2-4-9-17/h2-6,8-9,11-12,21H,7,10,13-16H2,1H3,(H,22,23).
What are the key properties of 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide?
2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 2.58, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)acetamide is sourced from PubChem (CID 109000620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).