N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide

C17H16FN3O4 — CID 24673894

IUPACN-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide
SMILESCC(=O)Nc1ccc(F)c(NC(=O)c2ccccc2OCC(N)=O)c1
InChIInChI=1S/C17H16FN3O4/c1-10(22)20-11-6-7-13(18)14(8-11)21-17(24)12-4-2-3-5-15(12)25-9-16(19)23/h2-8H,9H2,1H3,(H2,19,23)(H,20,22)(H,21,24)
InChIKeyGBHNHWZPBQGMDV-UHFFFAOYSA-N
MW345.33 g/mol
LogP1.90
Rot. Bonds6

About N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide

N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide (PubChem CID 24673894) has the molecular formula C17H16FN3O4 and a molecular weight of 345.33 g/mol. Its IUPAC name is N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide.

Molecular Properties

Compound NameN-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide
PubChem CID24673894
Molecular FormulaC17H16FN3O4
Molecular Weight345.33 g/mol
Exact Mass345.11
IUPAC NameN-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide
SMILESCC(=O)Nc1ccc(F)c(NC(=O)c2ccccc2OCC(N)=O)c1
InChIInChI=1S/C17H16FN3O4/c1-10(22)20-11-6-7-13(18)14(8-11)21-17(24)12-4-2-3-5-15(12)25-9-16(19)23/h2-8H,9H2,1H3,(H2,19,23)(H,20,22)(H,21,24)
InChIKeyGBHNHWZPBQGMDV-UHFFFAOYSA-N
XLogP1.90
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.33
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide?
The IUPAC name of N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide (CID 24673894) is N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide.
What is the SMILES notation for N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide?
The canonical SMILES for N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide is CC(=O)Nc1ccc(F)c(NC(=O)c2ccccc2OCC(N)=O)c1.
What is the InChIKey of N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide?
The InChIKey is GBHNHWZPBQGMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O4/c1-10(22)20-11-6-7-13(18)14(8-11)21-17(24)12-4-2-3-5-15(12)25-9-16(19)23/h2-8H,9H2,1H3,(H2,19,23)(H,20,22)(H,21,24).
What are the key properties of N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide?
N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide has a molecular weight of 345.33 g/mol, XLogP of 1.90, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-fluorophenyl)-2-(2-amino-2-oxoethoxy)benzamide is sourced from PubChem (CID 24673894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).