2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol

C13H14Cl2N2O — CID 63977323

IUPAC2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol
SMILESCCn1ccnc1C(O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C13H14Cl2N2O/c1-2-17-6-5-16-13(17)12(18)7-9-3-4-10(14)8-11(9)15/h3-6,8,12,18H,2,7H2,1H3
InChIKeyABJIINITPHZKAC-UHFFFAOYSA-N
MW285.17 g/mol
LogP3.49
Rot. Bonds4

About 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol

2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol (PubChem CID 63977323) has the molecular formula C13H14Cl2N2O and a molecular weight of 285.17 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol
PubChem CID63977323
Molecular FormulaC13H14Cl2N2O
Molecular Weight285.17 g/mol
Exact Mass284.05
IUPAC Name2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol
SMILESCCn1ccnc1C(O)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C13H14Cl2N2O/c1-2-17-6-5-16-13(17)12(18)7-9-3-4-10(14)8-11(9)15/h3-6,8,12,18H,2,7H2,1H3
InChIKeyABJIINITPHZKAC-UHFFFAOYSA-N
XLogP3.49
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.17
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol 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-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethyl]propan-1-amine
CID 63968753
1-(2,4-dichlorophenyl)-3-(1-ethylimidazol-2-yl)propan-2-amine
CID 79751664
2-(2,4-dichlorophenyl)-1-(3-ethylimidazol-4-yl)ethanol
CID 66134128
2-(2-chloro-6-fluorophenyl)-1-(1-ethylimidazol-2-yl)ethanol
CID 63975018
(5-chloro-2-fluorophenyl)-(1-ethylimidazol-2-yl)methanol
CID 61314413
2-(2-bromophenyl)-1-(1-ethylimidazol-2-yl)ethanol
CID 63975016
1-(1-ethylimidazol-2-yl)-2-phenylethanol
CID 63976496
N-[(2,4-dichlorophenyl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 54980096
1-(1-ethylimidazol-2-yl)-2-pyridin-2-ylethanol
CID 63977321
2-(2,4-dichlorophenyl)-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]ethanol
CID 106782715
2-(2,4-dichlorophenyl)-1-(1-methylpyrrol-3-yl)ethanol
CID 10612074
1,3-bis(2,4-dichlorophenyl)propan-2-ol
CID 63410533

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol (CID 63977323) is 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol is CCn1ccnc1C(O)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol?
The InChIKey is ABJIINITPHZKAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2O/c1-2-17-6-5-16-13(17)12(18)7-9-3-4-10(14)8-11(9)15/h3-6,8,12,18H,2,7H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol?
2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol has a molecular weight of 285.17 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-(1-ethylimidazol-2-yl)ethanol is sourced from PubChem (CID 63977323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).