N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide

C24H25NO5 — CID 17169883

IUPACN-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
SMILESCOCCOc1cccc(NC(=O)c2ccccc2OCCOc2ccccc2)c1
InChIInChI=1S/C24H25NO5/c1-27-14-15-29-21-11-7-8-19(18-21)25-24(26)22-12-5-6-13-23(22)30-17-16-28-20-9-3-2-4-10-20/h2-13,18H,14-17H2,1H3,(H,25,26)
InChIKeyCGQJFWGGMWDUJN-UHFFFAOYSA-N
MW407.47 g/mol
LogP4.42
Rot. Bonds11

About N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide

N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide (PubChem CID 17169883) has the molecular formula C24H25NO5 and a molecular weight of 407.47 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
PubChem CID17169883
Molecular FormulaC24H25NO5
Molecular Weight407.47 g/mol
Exact Mass407.17
IUPAC NameN-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
SMILESCOCCOc1cccc(NC(=O)c2ccccc2OCCOc2ccccc2)c1
InChIInChI=1S/C24H25NO5/c1-27-14-15-29-21-11-7-8-19(18-21)25-24(26)22-12-5-6-13-23(22)30-17-16-28-20-9-3-2-4-10-20/h2-13,18H,14-17H2,1H3,(H,25,26)
InChIKeyCGQJFWGGMWDUJN-UHFFFAOYSA-N
XLogP4.42
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylprop-2-enoxy)-N-[3-(2-phenoxyethoxy)phenyl]benzamide
CID 17130494
2-(2-phenylethoxy)-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142269
2-chloro-N-[3-(2-methoxyethoxy)phenyl]benzamide
CID 17169773
N-naphthalen-2-yl-2-(2-phenoxyethoxy)benzamide
CID 17231987
N-[(3-ethoxyphenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide
CID 17098406
2-(2-phenoxyethoxy)-N-[3-(2-sulfanylpropyl)phenyl]benzamide
CID 139322954
2-(2-ethoxyethoxy)-N-(3-methoxyphenyl)benzamide
CID 17122713
2-(2-ethoxyethoxy)-N-[[3-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide
CID 17123746
2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide
CID 4954419
N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954273
N-[3-(benzylcarbamoyl)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 28638908
2-(2-methoxyethoxy)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 56593348

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide?
The IUPAC name of N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide (CID 17169883) is N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide.
What is the SMILES notation for N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide?
The canonical SMILES for N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide is COCCOc1cccc(NC(=O)c2ccccc2OCCOc2ccccc2)c1.
What is the InChIKey of N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide?
The InChIKey is CGQJFWGGMWDUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO5/c1-27-14-15-29-21-11-7-8-19(18-21)25-24(26)22-12-5-6-13-23(22)30-17-16-28-20-9-3-2-4-10-20/h2-13,18H,14-17H2,1H3,(H,25,26).
What are the key properties of N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide?
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide has a molecular weight of 407.47 g/mol, XLogP of 4.42, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide is sourced from PubChem (CID 17169883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).