1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone

C14H16Cl2O2 — CID 115578570

IUPAC1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone
SMILESO=C(COc1cccc(Cl)c1Cl)C1CCCCC1
InChIInChI=1S/C14H16Cl2O2/c15-11-7-4-8-13(14(11)16)18-9-12(17)10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2
InChIKeySGJOMXOQFHQDQM-UHFFFAOYSA-N
MW287.19 g/mol
LogP4.52
Rot. Bonds4

About 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone

1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone (PubChem CID 115578570) has the molecular formula C14H16Cl2O2 and a molecular weight of 287.19 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone.

Molecular Properties

Compound Name1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone
PubChem CID115578570
Molecular FormulaC14H16Cl2O2
Molecular Weight287.19 g/mol
Exact Mass286.05
IUPAC Name1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone
SMILESO=C(COc1cccc(Cl)c1Cl)C1CCCCC1
InChIInChI=1S/C14H16Cl2O2/c15-11-7-4-8-13(14(11)16)18-9-12(17)10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2
InChIKeySGJOMXOQFHQDQM-UHFFFAOYSA-N
XLogP4.52
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.19
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-cyclohexyl-2-(2,3-dichlorophenoxy)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

2-(2-bromophenoxy)-1-cyclohexylethanone
CID 115578561
N-cyclopentyl-2-(2,3-dichlorophenoxy)acetamide
CID 2602948
2-(2-chloro-4-fluorophenoxy)-1-cyclohexylethanone
CID 115578096
1-cyclohexyl-2-(2,4-dichlorophenoxy)ethanone
CID 113220137
1-cyclohexyl-2-(2-fluoro-3-methylphenoxy)ethanone
CID 103988434
2-(2-cyclohexyl-2-oxoethoxy)benzonitrile
CID 113223270
2-(4-bromo-2-chlorophenoxy)-1-cyclopentylethanone
CID 115648637
2-(2-chloro-4-methylphenoxy)-1-cyclopentylethanone
CID 104752067
1-cyclohexyl-2-(2-methylsulfanylphenoxy)ethanone
CID 104752083
2-(2,3-dichlorophenoxy)-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 7787741
2-(2,3-dichlorophenoxy)-1-(2-ethylpiperidin-1-yl)ethanone
CID 17249017
1-cyclopentyl-2-(2-propan-2-ylphenoxy)ethanone
CID 104751801

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone?
The IUPAC name of 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone (CID 115578570) is 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone.
What is the SMILES notation for 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone?
The canonical SMILES for 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone is O=C(COc1cccc(Cl)c1Cl)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone?
The InChIKey is SGJOMXOQFHQDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2O2/c15-11-7-4-8-13(14(11)16)18-9-12(17)10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2.
What are the key properties of 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone?
1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone has a molecular weight of 287.19 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2,3-dichlorophenoxy)ethanone is sourced from PubChem (CID 115578570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).