2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone

C11H8ClFN2O — CID 82117132

IUPAC2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone
SMILESO=C(Cc1c(F)cccc1Cl)n1ccnc1
InChIInChI=1S/C11H8ClFN2O/c12-9-2-1-3-10(13)8(9)6-11(16)15-5-4-14-7-15/h1-5,7H,6H2
InChIKeyANMKMSPKBXBPGZ-UHFFFAOYSA-N
MW238.65 g/mol
LogP2.56
Rot. Bonds2

About 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone

2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone (PubChem CID 82117132) has the molecular formula C11H8ClFN2O and a molecular weight of 238.65 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone
PubChem CID82117132
Molecular FormulaC11H8ClFN2O
Molecular Weight238.65 g/mol
Exact Mass238.03
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone
SMILESO=C(Cc1c(F)cccc1Cl)n1ccnc1
InChIInChI=1S/C11H8ClFN2O/c12-9-2-1-3-10(13)8(9)6-11(16)15-5-4-14-7-15/h1-5,7H,6H2
InChIKeyANMKMSPKBXBPGZ-UHFFFAOYSA-N
XLogP2.56
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.65
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone 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-chloro-6-fluorophenyl)methyl]-N-cyclopropylimidazole-1-carboxamide
CID 112722748
2-(2-chloro-6-fluorophenyl)-N-(3-imidazol-1-ylpropyl)acetamide
CID 2963113
2-(2-chloro-6-fluorophenyl)-1-[(3S)-3-(triazol-2-yl)pyrrolidin-1-yl]ethanone
CID 124761260
2-(2-chloro-6-fluorophenyl)-1-(2-ethylpyrazol-3-yl)ethanone
CID 63974650
2-(2-chloro-6-fluorophenyl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)ethanone
CID 42942672
2-(2-chloro-6-fluorophenyl)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 8004063
2-(2-chloro-6-fluorophenyl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethanone
CID 61411008
2-(2-chloro-6-fluorophenyl)-1-(1-methylimidazol-4-yl)ethanone
CID 107976486
2-(2-chloro-6-fluorophenyl)-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]ethanone
CID 39807762
1-(1-aminocyclopropyl)-2-(2-chloro-6-fluorophenyl)ethanone
CID 116576500
2-(2-chloro-6-fluorophenyl)-N-(4-chlorophenyl)acetamide
CID 9413330
2-[(2-chloro-6-fluorophenyl)methyl]pyridazin-3-one
CID 99844131

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone (CID 82117132) is 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone is O=C(Cc1c(F)cccc1Cl)n1ccnc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone?
The InChIKey is ANMKMSPKBXBPGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2O/c12-9-2-1-3-10(13)8(9)6-11(16)15-5-4-14-7-15/h1-5,7H,6H2.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone?
2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone has a molecular weight of 238.65 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-imidazol-1-ylethanone is sourced from PubChem (CID 82117132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).