4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide

C17H17FN2O3 — CID 17218182

IUPAC4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H17FN2O3/c1-23-11-10-19-16(21)12-4-8-15(9-5-12)20-17(22)13-2-6-14(18)7-3-13/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyPUZQLZCNNQQXHL-UHFFFAOYSA-N
MW316.33 g/mol
LogP2.45
Rot. Bonds6

About 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide

4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide (PubChem CID 17218182) has the molecular formula C17H17FN2O3 and a molecular weight of 316.33 g/mol. Its IUPAC name is 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide
PubChem CID17218182
Molecular FormulaC17H17FN2O3
Molecular Weight316.33 g/mol
Exact Mass316.12
IUPAC Name4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C17H17FN2O3/c1-23-11-10-19-16(21)12-4-8-15(9-5-12)20-17(22)13-2-6-14(18)7-3-13/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyPUZQLZCNNQQXHL-UHFFFAOYSA-N
XLogP2.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-N-(4-acetylphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045198
4-[(4-fluoroanilino)methyl]-N-(2-methoxyethyl)benzamide
CID 110170555
methyl 2-[[4-[(4-fluorobenzoyl)amino]benzoyl]amino]acetate
CID 9049144
4-N-(4-ethoxyphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045187
4-N-(4-cyanophenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045241
N-(2-methoxyethyl)-4-[(4-propoxybenzoyl)amino]benzamide
CID 17218276
4-[(4-fluorobenzoyl)amino]-N-[2-[(4-iodobenzoyl)amino]ethyl]benzamide
CID 121062019
1-N-[2-(4-fluorophenyl)ethyl]-4-N-(4-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109048012
4-(4-fluorophenyl)-N-[4-(2-methoxyethylcarbamoyl)phenyl]piperazine-1-carboxamide
CID 56763318
6-N-(4-fluorophenyl)-2-N-(2-methoxyethyl)pyridine-2,6-dicarboxamide
CID 109095740
4-(2,2-dimethylpropanoylamino)-N-(2-methoxyethyl)benzamide
CID 17218245
N,N'-bis[4-(2-methoxyethylcarbamoyl)phenyl]hexanediamide
CID 17218594

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide (CID 17218182) is 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide?
The InChIKey is PUZQLZCNNQQXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O3/c1-23-11-10-19-16(21)12-4-8-15(9-5-12)20-17(22)13-2-6-14(18)7-3-13/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide?
4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide has a molecular weight of 316.33 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorobenzoyl)amino]-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 17218182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).