2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole

C11H20N2 — CID 25034505

IUPAC2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole
SMILESC1CCC(CCC2=NCCN2)CC1
InChIInChI=1S/C11H20N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h10H,1-9H2,(H,12,13)
InChIKeyYXZCYKOSJZGZBI-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.35
Rot. Bonds3

About 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole

2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole (PubChem CID 25034505) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole
PubChem CID25034505
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole
SMILESC1CCC(CCC2=NCCN2)CC1
InChIInChI=1S/C11H20N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h10H,1-9H2,(H,12,13)
InChIKeyYXZCYKOSJZGZBI-UHFFFAOYSA-N
XLogP2.35
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-cyclohexylethyl)-4,5-dihydro-1H-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 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole (CID 25034505) is 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole is C1CCC(CCC2=NCCN2)CC1.
What is the InChIKey of 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole?
The InChIKey is YXZCYKOSJZGZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h10H,1-9H2,(H,12,13).
What are the key properties of 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole?
2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole has a molecular weight of 180.29 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylethyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 25034505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).