N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide

C16H16ClFN2O — CID 52686374

IUPACN-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide
SMILESCCN(CC(=O)Nc1cccc(Cl)c1)c1cccc(F)c1
InChIInChI=1S/C16H16ClFN2O/c1-2-20(15-8-4-6-13(18)10-15)11-16(21)19-14-7-3-5-12(17)9-14/h3-10H,2,11H2,1H3,(H,19,21)
InChIKeyXQINRABWAQTBGF-UHFFFAOYSA-N
MW306.77 g/mol
LogP3.94
Rot. Bonds5

About N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide

N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide (PubChem CID 52686374) has the molecular formula C16H16ClFN2O and a molecular weight of 306.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide
PubChem CID52686374
Molecular FormulaC16H16ClFN2O
Molecular Weight306.77 g/mol
Exact Mass306.09
IUPAC NameN-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide
SMILESCCN(CC(=O)Nc1cccc(Cl)c1)c1cccc(F)c1
InChIInChI=1S/C16H16ClFN2O/c1-2-20(15-8-4-6-13(18)10-15)11-16(21)19-14-7-3-5-12(17)9-14/h3-10H,2,11H2,1H3,(H,19,21)
InChIKeyXQINRABWAQTBGF-UHFFFAOYSA-N
XLogP3.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide 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

N-(3-chlorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109008467
2-(3-amino-N-ethylanilino)-N-(3-chlorophenyl)acetamide
CID 63229764
2-(N-ethyl-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60517438
2-(3-chloro-N-methylsulfonylanilino)-N-(3-fluorophenyl)acetamide
CID 1318710
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethylamino]-N-(3-fluorophenyl)acetamide
CID 8780475
2-(N-ethylanilino)-N-(3-phenylphenyl)acetamide
CID 13221983
2-(3-chloro-N-methylsulfonylanilino)-N-(3-chlorophenyl)acetamide
CID 1082246
N-(3-chlorophenyl)-2-[(3-chlorophenyl)methyl-methylamino]acetamide
CID 9251258
N-(3,4-dichlorophenyl)-2-(N-ethylanilino)acetamide
CID 54808800
N-(3-aminophenyl)-2-(N-ethylanilino)acetamide
CID 16790236
N-(3-chlorophenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78962723
2-(N-acetyl-2,4-dichloroanilino)-N-(3-fluorophenyl)acetamide
CID 113179657

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide (CID 52686374) is N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide is CCN(CC(=O)Nc1cccc(Cl)c1)c1cccc(F)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide?
The InChIKey is XQINRABWAQTBGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O/c1-2-20(15-8-4-6-13(18)10-15)11-16(21)19-14-7-3-5-12(17)9-14/h3-10H,2,11H2,1H3,(H,19,21).
What are the key properties of N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide?
N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide has a molecular weight of 306.77 g/mol, XLogP of 3.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(N-ethyl-3-fluoroanilino)acetamide is sourced from PubChem (CID 52686374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).