2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide

C21H26N2O4 — CID 113166010

IUPAC2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN(CCOc1ccc(OC)cc1)C(C)=O)c1ccccc1
InChIInChI=1S/C21H26N2O4/c1-4-23(18-8-6-5-7-9-18)21(25)16-22(17(2)24)14-15-27-20-12-10-19(26-3)11-13-20/h5-13H,4,14-16H2,1-3H3
InChIKeyBPTCIZGOJCLRLS-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.98
Rot. Bonds9

About 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide

2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide (PubChem CID 113166010) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide
PubChem CID113166010
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC Name2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN(CCOc1ccc(OC)cc1)C(C)=O)c1ccccc1
InChIInChI=1S/C21H26N2O4/c1-4-23(18-8-6-5-7-9-18)21(25)16-22(17(2)24)14-15-27-20-12-10-19(26-3)11-13-20/h5-13H,4,14-16H2,1-3H3
InChIKeyBPTCIZGOJCLRLS-UHFFFAOYSA-N
XLogP2.98
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylpropanamide
CID 113122390
2-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]-N-ethyl-N-phenylacetamide
CID 113164876
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-methyl-N-phenylacetamide
CID 113165999
N-ethyl-2-(4-methoxyphenoxy)-N-phenylacetamide
CID 922695
[2-(N-ethylanilino)-2-oxoethyl] 3-(4-methoxyphenoxy)propanoate
CID 2375807
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2-ethylphenyl)acetamide
CID 113166008
3-(N-acetylanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 113123406
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 113166031
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(2,6-diethylphenyl)acetamide
CID 113166015
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-butan-2-ylacetamide
CID 113165945
3-(N-acetyl-2,4-dimethoxyanilino)-N-ethyl-N-phenylpropanamide
CID 113130135
[2-(N-(2-ethoxy-2-oxoethyl)anilino)-2-oxoethyl] 4-(4-methoxyphenoxy)butanoate
CID 55306615

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide?
The IUPAC name of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide (CID 113166010) is 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide.
What is the SMILES notation for 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide?
The canonical SMILES for 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide is CCN(C(=O)CN(CCOc1ccc(OC)cc1)C(C)=O)c1ccccc1.
What is the InChIKey of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide?
The InChIKey is BPTCIZGOJCLRLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-4-23(18-8-6-5-7-9-18)21(25)16-22(17(2)24)14-15-27-20-12-10-19(26-3)11-13-20/h5-13H,4,14-16H2,1-3H3.
What are the key properties of 2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide?
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-ethyl-N-phenylacetamide has a molecular weight of 370.45 g/mol, XLogP of 2.98, 9 rotatable bonds, 0 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-ethyl-N-phenylacetamide is sourced from PubChem (CID 113166010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).