1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide

C22H19FN2O3 — CID 109049866

IUPAC1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccccc3F)cc2)cc1
InChIInChI=1S/C22H19FN2O3/c1-2-28-18-13-11-17(12-14-18)24-21(26)15-7-9-16(10-8-15)22(27)25-20-6-4-3-5-19(20)23/h3-14H,2H2,1H3,(H,24,26)(H,25,27)
InChIKeyWUTKIURRFYYYTQ-UHFFFAOYSA-N
MW378.40 g/mol
LogP4.73
Rot. Bonds6

About 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide

1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide (PubChem CID 109049866) has the molecular formula C22H19FN2O3 and a molecular weight of 378.40 g/mol. Its IUPAC name is 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
PubChem CID109049866
Molecular FormulaC22H19FN2O3
Molecular Weight378.40 g/mol
Exact Mass378.14
IUPAC Name1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccccc3F)cc2)cc1
InChIInChI=1S/C22H19FN2O3/c1-2-28-18-13-11-17(12-14-18)24-21(26)15-7-9-16(10-8-15)22(27)25-20-6-4-3-5-19(20)23/h3-14H,2H2,1H3,(H,24,26)(H,25,27)
InChIKeyWUTKIURRFYYYTQ-UHFFFAOYSA-N
XLogP4.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.40
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N-(4-ethylphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049753
2-[[4-[(4-ethoxybenzoyl)amino]benzoyl]amino]benzoate
CID 9325388
N-(4-ethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 4952680
N-(3-acetamido-4-fluorophenyl)-4-ethoxybenzamide
CID 46632768
N-(4-ethoxyphenyl)-3-[(2-fluorobenzoyl)amino]-4-methylbenzamide
CID 39707326
N-(2-acetamidophenyl)-4-ethoxybenzamide
CID 891466
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
CID 26243690
N-(2-ethoxyphenyl)-4-[(4-methoxybenzoyl)amino]benzamide
CID 2222263
N-[4-[(4-bromobenzoyl)amino]phenyl]-4-ethoxybenzamide
CID 23876301
N-(4-chloro-2-fluorophenyl)-4-ethoxybenzamide
CID 897315
5-ethoxy-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 146277110

Frequently Asked Questions

What is the IUPAC name of 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide?
The IUPAC name of 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide (CID 109049866) is 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide is CCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccccc3F)cc2)cc1.
What is the InChIKey of 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide?
The InChIKey is WUTKIURRFYYYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O3/c1-2-28-18-13-11-17(12-14-18)24-21(26)15-7-9-16(10-8-15)22(27)25-20-6-4-3-5-19(20)23/h3-14H,2H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide?
1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide has a molecular weight of 378.40 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 109049866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).