2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone

C16H14ClFO — CID 43160436

IUPAC2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)Cc2c(F)cccc2Cl)cc1
InChIInChI=1S/C16H14ClFO/c1-2-11-6-8-12(9-7-11)16(19)10-13-14(17)4-3-5-15(13)18/h3-9H,2,10H2,1H3
InChIKeyMXRHRNWJZZXWAU-UHFFFAOYSA-N
MW276.74 g/mol
LogP4.47
Rot. Bonds4

About 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone

2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone (PubChem CID 43160436) has the molecular formula C16H14ClFO and a molecular weight of 276.74 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone
PubChem CID43160436
Molecular FormulaC16H14ClFO
Molecular Weight276.74 g/mol
Exact Mass276.07
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)Cc2c(F)cccc2Cl)cc1
InChIInChI=1S/C16H14ClFO/c1-2-11-6-8-12(9-7-11)16(19)10-13-14(17)4-3-5-15(13)18/h3-9H,2,10H2,1H3
InChIKeyMXRHRNWJZZXWAU-UHFFFAOYSA-N
XLogP4.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.74
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone 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

1-(4-tert-butylphenyl)-2-(2-chloro-6-fluorophenyl)ethanone
CID 43337746
2-(2-chloro-6-fluorophenyl)-1-(4-ethylsulfanylphenyl)ethanone
CID 106847868
N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-ethylbenzohydrazide
CID 8879631
2-(2-chloro-6-fluorophenyl)-1-(4-chloro-3-fluorophenyl)ethanone
CID 114024581
2-(2,3-dichlorophenyl)-1-(4-ethylphenyl)ethanone
CID 107307811
1-(4-chlorophenyl)-2-(2,6-dichlorophenyl)ethanone
CID 63411340
2-(2-chloro-6-fluorophenyl)-1-(3,4-dimethoxyphenyl)ethanone
CID 43160866
2-(2-chloro-6-fluorophenyl)-1-(3-ethyl-2-pyridinyl)ethanone
CID 82730026
2-(2-chloro-6-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone
CID 43379521
2-(2-chloro-6-fluorophenyl)-1-(2,4,6-trichlorophenyl)ethanone
CID 105349147
2-(2-chloro-6-fluorophenyl)-1-(2,4-dimethylphenyl)ethanone
CID 43337883
1-(2-chloro-4,5-difluorophenyl)-2-(2-chloro-6-fluorophenyl)ethanone
CID 107475686

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone (CID 43160436) is 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone is CCc1ccc(C(=O)Cc2c(F)cccc2Cl)cc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone?
The InChIKey is MXRHRNWJZZXWAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClFO/c1-2-11-6-8-12(9-7-11)16(19)10-13-14(17)4-3-5-15(13)18/h3-9H,2,10H2,1H3.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone?
2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone has a molecular weight of 276.74 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-(4-ethylphenyl)ethanone is sourced from PubChem (CID 43160436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).