N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide

C24H25NO4 — CID 60546146

IUPACN-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)CCOCc2ccccc2)cc1
InChIInChI=1S/C24H25NO4/c1-2-28-20-12-14-21(15-13-20)29-23-11-7-6-10-22(23)25-24(26)16-17-27-18-19-8-4-3-5-9-19/h3-15H,2,16-18H2,1H3,(H,25,26)
InChIKeyMCEQMVYYRUANPF-UHFFFAOYSA-N
MW391.47 g/mol
LogP5.42
Rot. Bonds10

About N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide

N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide (PubChem CID 60546146) has the molecular formula C24H25NO4 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide
PubChem CID60546146
Molecular FormulaC24H25NO4
Molecular Weight391.47 g/mol
Exact Mass391.18
IUPAC NameN-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)CCOCc2ccccc2)cc1
InChIInChI=1S/C24H25NO4/c1-2-28-20-12-14-21(15-13-20)29-23-11-7-6-10-22(23)25-24(26)16-17-27-18-19-8-4-3-5-9-19/h3-15H,2,16-18H2,1H3,(H,25,26)
InChIKeyMCEQMVYYRUANPF-UHFFFAOYSA-N
XLogP5.42
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.47
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(4-ethylphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 108795900
N-[2-(4-ethoxyphenoxy)phenyl]-2-(4-hydroxyphenyl)acetamide
CID 78838328
N-[2-(4-ethoxyphenoxy)phenyl]-2-(2-methoxyethoxy)acetamide
CID 43037548
N-[2-(4-ethoxyphenoxy)phenyl]-3-pyridin-3-ylpropanamide
CID 29224760
N-[2-(4-ethoxyphenoxy)phenyl]-2-thiophen-3-ylacetamide
CID 8002490
4-[2-(4-ethoxyphenoxy)anilino]-2,2-dimethyl-4-oxobutanoic acid
CID 119133553
N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide
CID 31895143
N-[2-(4-ethoxyphenoxy)phenyl]-2-phenoxypropanamide
CID 18170387
N-(2-ethoxyphenyl)-3-phenylpropanamide
CID 849126
N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
N-[2-[2-(4-ethoxyphenoxy)anilino]-2-oxoethyl]-3,3-dimethylbutanamide
CID 60567011
N-[2-(4-ethoxyphenoxy)phenyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide
CID 18198211

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide?
The IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide (CID 60546146) is N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide.
What is the SMILES notation for N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide?
The canonical SMILES for N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide is CCOc1ccc(Oc2ccccc2NC(=O)CCOCc2ccccc2)cc1.
What is the InChIKey of N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide?
The InChIKey is MCEQMVYYRUANPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4/c1-2-28-20-12-14-21(15-13-20)29-23-11-7-6-10-22(23)25-24(26)16-17-27-18-19-8-4-3-5-9-19/h3-15H,2,16-18H2,1H3,(H,25,26).
What are the key properties of N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide?
N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide has a molecular weight of 391.47 g/mol, XLogP of 5.42, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenoxy)phenyl]-3-phenylmethoxypropanamide is sourced from PubChem (CID 60546146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).