4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole

C13H14Cl2N2O — CID 17272657

IUPAC4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole
SMILESCCc1nc(Cl)c(Cl)n1CCOc1ccccc1
InChIInChI=1S/C13H14Cl2N2O/c1-2-11-16-12(14)13(15)17(11)8-9-18-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKeyRHNSHNNXZRZABI-UHFFFAOYSA-N
MW285.17 g/mol
LogP3.83
Rot. Bonds5

About 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole

4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole (PubChem CID 17272657) has the molecular formula C13H14Cl2N2O and a molecular weight of 285.17 g/mol. Its IUPAC name is 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole.

Molecular Properties

Compound Name4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole
PubChem CID17272657
Molecular FormulaC13H14Cl2N2O
Molecular Weight285.17 g/mol
Exact Mass284.05
IUPAC Name4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole
SMILESCCc1nc(Cl)c(Cl)n1CCOc1ccccc1
InChIInChI=1S/C13H14Cl2N2O/c1-2-11-16-12(14)13(15)17(11)8-9-18-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKeyRHNSHNNXZRZABI-UHFFFAOYSA-N
XLogP3.83
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.17
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole 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-ethyl-1-[2-(4-propan-2-ylphenoxy)ethyl]benzimidazole
CID 16996424
2-ethyl-1-(4-pyridin-4-yloxybutyl)benzimidazole
CID 122190781
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]-1,1,2,2,3,3-hexadeuteriopropyl]-5-ethyl-4-(2-phenoxyethyl)-1,2,4-triazol-3-one
CID 71750977
1-(2-phenoxyethyl)-2-(phenoxymethyl)benzimidazole
CID 709525
4-(2-phenoxyethyl)-3-propyl-1H-1,2,4-triazole-5-thione
CID 55017666
2-[(1R)-1-phenoxyethyl]-1-(2-phenoxyethyl)benzimidazole
CID 7574593
1-ethyl-3-(2-phenoxyethyl)benzimidazol-2-imine
CID 762258
2-[(2-chlorophenyl)methyl]-1-[2-(4-ethylphenoxy)ethyl]benzimidazole
CID 16995718
6-chloro-1-(2-methoxyethyl)-2-(phenoxymethyl)benzimidazole
CID 46309145
6-methyl-2-(2-phenoxyethyl)pyridazin-3-one
CID 129259620
7-chloro-3-methyl-1-(2-phenoxyethyl)quinolin-2-one
CID 169128473
3-[2-(2-ethyl-5,6-difluorobenzimidazol-1-yl)ethoxy]aniline
CID 94757335

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole?
The IUPAC name of 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole (CID 17272657) is 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole.
What is the SMILES notation for 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole?
The canonical SMILES for 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole is CCc1nc(Cl)c(Cl)n1CCOc1ccccc1.
What is the InChIKey of 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole?
The InChIKey is RHNSHNNXZRZABI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2O/c1-2-11-16-12(14)13(15)17(11)8-9-18-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3.
What are the key properties of 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole?
4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole has a molecular weight of 285.17 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-2-ethyl-1-(2-phenoxyethyl)imidazole is sourced from PubChem (CID 17272657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).