1-[2-(2-chlorophenyl)hexyl]imidazole

C15H19ClN2 — CID 3006823

IUPAC1-[2-(2-chlorophenyl)hexyl]imidazole
SMILESCCCCC(Cn1ccnc1)c1ccccc1Cl
InChIInChI=1S/C15H19ClN2/c1-2-3-6-13(11-18-10-9-17-12-18)14-7-4-5-8-15(14)16/h4-5,7-10,12-13H,2-3,6,11H2,1H3
InChIKeyQHNMYBCLFWIHHR-UHFFFAOYSA-N
MW262.78 g/mol
LogP4.51
Rot. Bonds6

About 1-[2-(2-chlorophenyl)hexyl]imidazole

1-[2-(2-chlorophenyl)hexyl]imidazole (PubChem CID 3006823) has the molecular formula C15H19ClN2 and a molecular weight of 262.78 g/mol. Its IUPAC name is 1-[2-(2-chlorophenyl)hexyl]imidazole.

Molecular Properties

Compound Name1-[2-(2-chlorophenyl)hexyl]imidazole
PubChem CID3006823
Molecular FormulaC15H19ClN2
Molecular Weight262.78 g/mol
Exact Mass262.12
IUPAC Name1-[2-(2-chlorophenyl)hexyl]imidazole
SMILESCCCCC(Cn1ccnc1)c1ccccc1Cl
InChIInChI=1S/C15H19ClN2/c1-2-3-6-13(11-18-10-9-17-12-18)14-7-4-5-8-15(14)16/h4-5,7-10,12-13H,2-3,6,11H2,1H3
InChIKeyQHNMYBCLFWIHHR-UHFFFAOYSA-N
XLogP4.51
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[2-(2-chlorophenyl)hexyl]imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-chlorophenyl)hexyl]imidazole?
The IUPAC name of 1-[2-(2-chlorophenyl)hexyl]imidazole (CID 3006823) is 1-[2-(2-chlorophenyl)hexyl]imidazole.
What is the SMILES notation for 1-[2-(2-chlorophenyl)hexyl]imidazole?
The canonical SMILES for 1-[2-(2-chlorophenyl)hexyl]imidazole is CCCCC(Cn1ccnc1)c1ccccc1Cl.
What is the InChIKey of 1-[2-(2-chlorophenyl)hexyl]imidazole?
The InChIKey is QHNMYBCLFWIHHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2/c1-2-3-6-13(11-18-10-9-17-12-18)14-7-4-5-8-15(14)16/h4-5,7-10,12-13H,2-3,6,11H2,1H3.
What are the key properties of 1-[2-(2-chlorophenyl)hexyl]imidazole?
1-[2-(2-chlorophenyl)hexyl]imidazole has a molecular weight of 262.78 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-chlorophenyl)hexyl]imidazole is sourced from PubChem (CID 3006823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).