N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide

C17H16FNO2 — CID 134030150

IUPACN-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide
SMILESCc1ccc(C(=O)C(=O)NCCc2ccc(F)cc2)cc1
InChIInChI=1S/C17H16FNO2/c1-12-2-6-14(7-3-12)16(20)17(21)19-11-10-13-4-8-15(18)9-5-13/h2-9H,10-11H2,1H3,(H,19,21)
InChIKeyZQLKNEYPDCAWSL-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.68
Rot. Bonds5

About N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide

N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide (PubChem CID 134030150) has the molecular formula C17H16FNO2 and a molecular weight of 285.32 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide
PubChem CID134030150
Molecular FormulaC17H16FNO2
Molecular Weight285.32 g/mol
Exact Mass285.12
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide
SMILESCc1ccc(C(=O)C(=O)NCCc2ccc(F)cc2)cc1
InChIInChI=1S/C17H16FNO2/c1-12-2-6-14(7-3-12)16(20)17(21)19-11-10-13-4-8-15(18)9-5-13/h2-9H,10-11H2,1H3,(H,19,21)
InChIKeyZQLKNEYPDCAWSL-UHFFFAOYSA-N
XLogP2.68
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide 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-[2-(4-methoxyphenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide
CID 134060022
1-[2-(4-fluorophenyl)ethyl]-3-[3-(4-methylphenyl)-3-oxopropyl]urea
CID 108874692
methyl 2-[2-(4-fluorophenyl)ethylamino]-2-oxoacetate
CID 112616592
N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
CID 3117526
N-[2-(4-fluorophenyl)ethyl]-3,4-dimethylbenzamide
CID 3946122
N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)sulfanylacetamide
CID 977302
4-N-[2-(4-fluorophenyl)ethyl]-1-N-propylbenzene-1,4-dicarboxamide
CID 109042913
N-[2-(4-fluorophenyl)ethyl]-N'-(3-methylbutyl)oxamide
CID 108531969
4-(bromomethyl)-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 11131484
N-[2-(4-fluorophenyl)ethyl]-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
CID 24606211
1-[2-(4-fluorophenyl)ethyl]-3-[(4-methylphenoxy)methyl]urea
CID 108893063
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-[2-(4-methylphenyl)ethyl]urea
CID 108908257

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide (CID 134030150) is N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide is Cc1ccc(C(=O)C(=O)NCCc2ccc(F)cc2)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide?
The InChIKey is ZQLKNEYPDCAWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO2/c1-12-2-6-14(7-3-12)16(20)17(21)19-11-10-13-4-8-15(18)9-5-13/h2-9H,10-11H2,1H3,(H,19,21).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide?
N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide has a molecular weight of 285.32 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-(4-methylphenyl)-2-oxoacetamide is sourced from PubChem (CID 134030150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).