3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide

C20H24N2O4 — CID 17234430

IUPAC3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)c2cccc(OCCOCC)c2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-21-19(23)15-8-10-17(11-9-15)22-20(24)16-6-5-7-18(14-16)26-13-12-25-4-2/h5-11,14H,3-4,12-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyCZELAOVKKFUNTA-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.10
Rot. Bonds9

About 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide

3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide (PubChem CID 17234430) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
PubChem CID17234430
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)c2cccc(OCCOCC)c2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-21-19(23)15-8-10-17(11-9-15)22-20(24)16-6-5-7-18(14-16)26-13-12-25-4-2/h5-11,14H,3-4,12-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyCZELAOVKKFUNTA-UHFFFAOYSA-N
XLogP3.10
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.10
H-Bond Donors ≤ 52
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-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139535
N-(4-acetamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139517
N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
CID 17231253
N-(4-carbamoylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139541
3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide
CID 17139540
3-(2-ethoxyethoxy)-N-[4-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 28638494
propyl 4-[[3-(2-ethoxyethoxy)benzoyl]amino]benzoate
CID 17139559
N-(3-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 2238701
N-(3,4-dichlorophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139550
N-(4-benzamidophenyl)-4-(2-ethoxyethoxy)benzamide
CID 17235471
4-(2-ethoxyethoxy)-N-[4-[[4-(2-ethoxyethoxy)benzoyl]amino]phenyl]benzamide
CID 17113406

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide (CID 17234430) is 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide is CCNC(=O)c1ccc(NC(=O)c2cccc(OCCOCC)c2)cc1.
What is the InChIKey of 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide?
The InChIKey is CZELAOVKKFUNTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-21-19(23)15-8-10-17(11-9-15)22-20(24)16-6-5-7-18(14-16)26-13-12-25-4-2/h5-11,14H,3-4,12-13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide?
3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide has a molecular weight of 356.42 g/mol, XLogP of 3.10, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17234430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).