2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide

C24H25NO4 — CID 4954419

IUPAC2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide
SMILESCCCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1
InChIInChI=1S/C24H25NO4/c1-2-16-27-21-14-12-19(13-15-21)25-24(26)22-10-6-7-11-23(22)29-18-17-28-20-8-4-3-5-9-20/h3-15H,2,16-18H2,1H3,(H,25,26)
InChIKeyYBSXUFUFPWIHTG-UHFFFAOYSA-N
MW391.47 g/mol
LogP5.19
Rot. Bonds10

About 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide

2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide (PubChem CID 4954419) has the molecular formula C24H25NO4 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide
PubChem CID4954419
Molecular FormulaC24H25NO4
Molecular Weight391.47 g/mol
Exact Mass391.18
IUPAC Name2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide
SMILESCCCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1
InChIInChI=1S/C24H25NO4/c1-2-16-27-21-14-12-19(13-15-21)25-24(26)22-10-6-7-11-23(22)29-18-17-28-20-8-4-3-5-9-20/h3-15H,2,16-18H2,1H3,(H,25,26)
InChIKeyYBSXUFUFPWIHTG-UHFFFAOYSA-N
XLogP5.19
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 ≤ 55.19
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

2-butoxy-N-(4-propoxyphenyl)benzamide
CID 4943156
N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954273
2-hexoxy-N-[4-(2-phenoxyethoxy)phenyl]benzamide
CID 4958241
2-pentoxy-N-(4-propoxyphenyl)benzamide
CID 4946753
N-(4-ethoxyphenyl)-2-[[2-(2-phenoxyethoxy)benzoyl]amino]benzamide
CID 4954400
N-(4-butoxyphenyl)-2-(2-phenylethoxy)benzamide
CID 19628186
2-ethoxy-N-[4-(2-ethoxyethoxy)phenyl]benzamide
CID 17130609
2-(2-phenoxyethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4954384
N-[4-(tert-butylcarbamoyl)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17199542
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
N-naphthalen-2-yl-2-(2-phenoxyethoxy)benzamide
CID 17231987
2-iodo-N-(4-propoxyphenyl)benzamide
CID 4942969

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide?
The IUPAC name of 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide (CID 4954419) is 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide.
What is the SMILES notation for 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide?
The canonical SMILES for 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide is CCCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1.
What is the InChIKey of 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide?
The InChIKey is YBSXUFUFPWIHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4/c1-2-16-27-21-14-12-19(13-15-21)25-24(26)22-10-6-7-11-23(22)29-18-17-28-20-8-4-3-5-9-20/h3-15H,2,16-18H2,1H3,(H,25,26).
What are the key properties of 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide?
2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide has a molecular weight of 391.47 g/mol, XLogP of 5.19, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide is sourced from PubChem (CID 4954419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).