3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide

C23H23NO4 — CID 17139540

IUPAC3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H23NO4/c1-2-26-15-16-27-22-10-6-7-18(17-22)23(25)24-19-11-13-21(14-12-19)28-20-8-4-3-5-9-20/h3-14,17H,2,15-16H2,1H3,(H,24,25)
InChIKeyLULPTCZOLKRXDQ-UHFFFAOYSA-N
MW377.44 g/mol
LogP5.15
Rot. Bonds9

About 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide

3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide (PubChem CID 17139540) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide
PubChem CID17139540
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC Name3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H23NO4/c1-2-26-15-16-27-22-10-6-7-18(17-22)23(25)24-19-11-13-21(14-12-19)28-20-8-4-3-5-9-20/h3-14,17H,2,15-16H2,1H3,(H,24,25)
InChIKeyLULPTCZOLKRXDQ-UHFFFAOYSA-N
XLogP5.15
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.44
LogP ≤ 55.15
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

N-(4-benzamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17235482
N-(4-acetamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139517
N-(4-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139535
N-(4-carbamoylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139541
N-[4-(2-phenoxyethoxy)phenyl]-3-propoxybenzamide
CID 4960126
3-butoxy-N-[4-(2-phenoxyethoxy)phenyl]benzamide
CID 4958264
N-(4-butoxyphenyl)-3-(2-phenoxyethoxy)benzamide
CID 4955059
N-(4-benzamidophenyl)-4-(2-ethoxyethoxy)benzamide
CID 17235471
3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
CID 17234430
2-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-phenylbenzamide
CID 17139549
N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
CID 17231253
3-(3-methylbutoxy)-N-(4-phenoxyphenyl)benzamide
CID 4981650

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide?
The IUPAC name of 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide (CID 17139540) is 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide.
What is the SMILES notation for 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide?
The canonical SMILES for 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide is CCOCCOc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide?
The InChIKey is LULPTCZOLKRXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO4/c1-2-26-15-16-27-22-10-6-7-18(17-22)23(25)24-19-11-13-21(14-12-19)28-20-8-4-3-5-9-20/h3-14,17H,2,15-16H2,1H3,(H,24,25).
What are the key properties of 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide?
3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide has a molecular weight of 377.44 g/mol, XLogP of 5.15, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide is sourced from PubChem (CID 17139540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).