2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide

C17H21FN2O4 — CID 112774564

IUPAC2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESCC(=O)c1cc(F)ccc1OCC(=O)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H21FN2O4/c1-11(21)14-9-12(18)7-8-15(14)24-10-16(22)20-17(23)19-13-5-3-2-4-6-13/h7-9,13H,2-6,10H2,1H3,(H2,19,20,22,23)
InChIKeyBYNQRWFEASJWCW-UHFFFAOYSA-N
MW336.36 g/mol
LogP2.57
Rot. Bonds5

About 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide

2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide (PubChem CID 112774564) has the molecular formula C17H21FN2O4 and a molecular weight of 336.36 g/mol. Its IUPAC name is 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide
PubChem CID112774564
Molecular FormulaC17H21FN2O4
Molecular Weight336.36 g/mol
Exact Mass336.15
IUPAC Name2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESCC(=O)c1cc(F)ccc1OCC(=O)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H21FN2O4/c1-11(21)14-9-12(18)7-8-15(14)24-10-16(22)20-17(23)19-13-5-3-2-4-6-13/h7-9,13H,2-6,10H2,1H3,(H2,19,20,22,23)
InChIKeyBYNQRWFEASJWCW-UHFFFAOYSA-N
XLogP2.57
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)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

2-(2-acetyl-4-fluorophenoxy)-N-(4-methylcyclohexyl)acetamide
CID 4794961
2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide
CID 7167631
2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylmethyl)acetamide
CID 112774632
N-(cyclohexylcarbamoyl)-2-(2,4-dimethylphenoxy)acetamide
CID 7706804
2-[2-(cyclohexylcarbamoylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980853
2-(2-amino-4-fluorophenoxy)-N-cyclohexylacetamide
CID 55068862
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 4-fluorobenzoate
CID 2634322
2-(2-acetyl-4-fluorophenoxy)-N-propylacetamide
CID 71628000
2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide
CID 7698272
N-[3-acetyl-4-[2-(cycloheptylamino)-2-oxoethoxy]phenyl]butanamide
CID 31471779
N-(cyclohexylcarbamoyl)-2-(3,4-dimethylphenoxy)acetamide
CID 7610559
2-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-N-cyclopentylacetamide
CID 78935687

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The IUPAC name of 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide (CID 112774564) is 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide.
What is the SMILES notation for 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The canonical SMILES for 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide is CC(=O)c1cc(F)ccc1OCC(=O)NC(=O)NC1CCCCC1.
What is the InChIKey of 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The InChIKey is BYNQRWFEASJWCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O4/c1-11(21)14-9-12(18)7-8-15(14)24-10-16(22)20-17(23)19-13-5-3-2-4-6-13/h7-9,13H,2-6,10H2,1H3,(H2,19,20,22,23).
What are the key properties of 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide has a molecular weight of 336.36 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide is sourced from PubChem (CID 112774564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).