2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide

C23H30N2O4 — CID 113166015

IUPAC2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN(CCOc1ccc(OC)cc1)C(C)=O
InChIInChI=1S/C23H30N2O4/c1-5-18-8-7-9-19(6-2)23(18)24-22(27)16-25(17(3)26)14-15-29-21-12-10-20(28-4)11-13-21/h7-13H,5-6,14-16H2,1-4H3,(H,24,27)
InChIKeyCNWWANCTEYDBEA-UHFFFAOYSA-N
MW398.50 g/mol
LogP3.69
Rot. Bonds10

About 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide

2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide (PubChem CID 113166015) has the molecular formula C23H30N2O4 and a molecular weight of 398.50 g/mol. Its IUPAC name is 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide
PubChem CID113166015
Molecular FormulaC23H30N2O4
Molecular Weight398.50 g/mol
Exact Mass398.22
IUPAC Name2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN(CCOc1ccc(OC)cc1)C(C)=O
InChIInChI=1S/C23H30N2O4/c1-5-18-8-7-9-19(6-2)23(18)24-22(27)16-25(17(3)26)14-15-29-21-12-10-20(28-4)11-13-21/h7-13H,5-6,14-16H2,1-4H3,(H,24,27)
InChIKeyCNWWANCTEYDBEA-UHFFFAOYSA-N
XLogP3.69
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.50
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2-ethylphenyl)acetamide
CID 113166008
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 113166031
3-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-dimethylphenyl)propanamide
CID 113122386
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-butan-2-ylacetamide
CID 113165945
N-(2-ethyl-6-methylphenyl)-4-(4-methoxyphenoxy)butanamide
CID 7783546
N-(2,6-diethylphenyl)-2-[ethyl-(4-methoxyphenyl)sulfonylamino]acetamide
CID 45371949
2-[acetyl(2-methylpropyl)amino]-N-(2,6-diethylphenyl)acetamide
CID 13294808
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide
CID 113166010
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-methyl-N-phenylacetamide
CID 113165999
3-[acetyl(3-methoxypropyl)amino]-N-(2,6-diethylphenyl)propanamide
CID 113117165
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 113164231
3-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-propan-2-ylpropanamide
CID 113122339

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide?
The IUPAC name of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide (CID 113166015) is 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide?
The canonical SMILES for 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide is CCc1cccc(CC)c1NC(=O)CN(CCOc1ccc(OC)cc1)C(C)=O.
What is the InChIKey of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide?
The InChIKey is CNWWANCTEYDBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O4/c1-5-18-8-7-9-19(6-2)23(18)24-22(27)16-25(17(3)26)14-15-29-21-12-10-20(28-4)11-13-21/h7-13H,5-6,14-16H2,1-4H3,(H,24,27).
What are the key properties of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide?
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide has a molecular weight of 398.50 g/mol, XLogP of 3.69, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide is sourced from PubChem (CID 113166015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).