1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol

C11H10Cl2N2O — CID 12760611

IUPAC1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol
SMILESOC(Cn1ccnc1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H10Cl2N2O/c12-8-1-2-10(13)9(5-8)11(16)6-15-4-3-14-7-15/h1-5,7,11,16H,6H2
InChIKeyVBPAZUODEGXWRA-UHFFFAOYSA-N
MW257.12 g/mol
LogP2.92
Rot. Bonds3

About 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol

1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol (PubChem CID 12760611) has the molecular formula C11H10Cl2N2O and a molecular weight of 257.12 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol
PubChem CID12760611
Molecular FormulaC11H10Cl2N2O
Molecular Weight257.12 g/mol
Exact Mass256.02
IUPAC Name1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol
SMILESOC(Cn1ccnc1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H10Cl2N2O/c12-8-1-2-10(13)9(5-8)11(16)6-15-4-3-14-7-15/h1-5,7,11,16H,6H2
InChIKeyVBPAZUODEGXWRA-UHFFFAOYSA-N
XLogP2.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.12
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(2,4-dichlorophenyl)-2-imidazol-1-ylethanol
CID 853401
1-(2,5-dichlorophenyl)-2-(2-imidazol-1-ylethylamino)ethanol
CID 61463037
1-(2-chlorophenyl)-2-imidazol-1-ylethanol
CID 12760607
1-(4-chloro-3-fluorophenyl)-2-imidazol-1-ylethanol
CID 156700970
1-(2,6-dichlorophenyl)-2-imidazol-1-ylethanol
CID 12760610
1-[4-(2,4-dichlorophenoxy)phenyl]-2-imidazol-1-ylethanol
CID 20525170
4-chloro-2-[1-hydroxy-2-(imidazol-1-ylmethyl)butyl]phenol
CID 141049250
O-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] carbamothioate
CID 140542063
[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] 3,4-dichlorobenzoate
CID 21422347
1-[2-(2,4-dichlorophenyl)-2-(2-methylprop-2-enoxy)ethyl]imidazole
CID 3009144
1-[2-(2,4-dichlorophenyl)-2-prop-2-ynylsulfanylethyl]imidazole
CID 21402168
1-[2-(2,4-dichlorophenyl)-2-propylsulfanylethyl]imidazole
CID 21402411

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol (CID 12760611) is 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol is OC(Cn1ccnc1)c1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol?
The InChIKey is VBPAZUODEGXWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O/c12-8-1-2-10(13)9(5-8)11(16)6-15-4-3-14-7-15/h1-5,7,11,16H,6H2.
What are the key properties of 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol?
1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol has a molecular weight of 257.12 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol is sourced from PubChem (CID 12760611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).