5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde

C10H6Cl2N2O — CID 130855866

IUPAC5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde
SMILESO=Cc1ncc(-c2c(Cl)cccc2Cl)[nH]1
InChIInChI=1S/C10H6Cl2N2O/c11-6-2-1-3-7(12)10(6)8-4-13-9(5-15)14-8/h1-5H,(H,13,14)
InChIKeyZDNDJPIDACNMFK-UHFFFAOYSA-N
MW241.08 g/mol
LogP3.20
Rot. Bonds2

About 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde

5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde (PubChem CID 130855866) has the molecular formula C10H6Cl2N2O and a molecular weight of 241.08 g/mol. Its IUPAC name is 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde.

Molecular Properties

Compound Name5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde
PubChem CID130855866
Molecular FormulaC10H6Cl2N2O
Molecular Weight241.08 g/mol
Exact Mass239.99
IUPAC Name5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde
SMILESO=Cc1ncc(-c2c(Cl)cccc2Cl)[nH]1
InChIInChI=1S/C10H6Cl2N2O/c11-6-2-1-3-7(12)10(6)8-4-13-9(5-15)14-8/h1-5H,(H,13,14)
InChIKeyZDNDJPIDACNMFK-UHFFFAOYSA-N
XLogP3.20
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.08
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-tert-butyl-5-(2,6-dichlorophenyl)-1H-imidazole
CID 67456289
5-(4-methylphenyl)-1H-imidazole-2-carbaldehyde
CID 63925966
5-(2,6-dichlorophenyl)-2-(1H-pyrrol-2-yl)-1H-imidazole
CID 150674628
5-(5-methylthiophen-2-yl)-1H-imidazole-2-carbaldehyde
CID 63926585
5-(2,6-dichlorophenyl)-1,3-thiazole-2-carbaldehyde
CID 53271773
5-(2,6-dichlorophenyl)-1H-pyrazole
CID 15766319
3-amino-6-(2,3-dichlorophenyl)-1H-pyrazin-2-one
CID 178183737
3-[5-(2,6-dichlorophenyl)-1H-imidazol-2-yl]-5-(1H-pyrazol-4-yl)pyridin-2-amine
CID 141449955
2,6-dichlorobenzaldehyde;ethane
CID 90823593
5-(2,3-dichlorophenyl)pyrimidine-2-carbaldehyde
CID 130088699
5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole
CID 52941240
5-(2,3-dichlorophenyl)-2-[(3,5-dichlorophenyl)methyl]-1H-imidazole
CID 141255824

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde?
The IUPAC name of 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde (CID 130855866) is 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde.
What is the SMILES notation for 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde?
The canonical SMILES for 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde is O=Cc1ncc(-c2c(Cl)cccc2Cl)[nH]1.
What is the InChIKey of 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde?
The InChIKey is ZDNDJPIDACNMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O/c11-6-2-1-3-7(12)10(6)8-4-13-9(5-15)14-8/h1-5H,(H,13,14).
What are the key properties of 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde?
5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde has a molecular weight of 241.08 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dichlorophenyl)-1H-imidazole-2-carbaldehyde is sourced from PubChem (CID 130855866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).