1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole

C15H25N3 — CID 114706222

IUPAC1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole
SMILESCC1CCC(n2cncc2C2CCCN2)C(C)C1
InChIInChI=1S/C15H25N3/c1-11-5-6-14(12(2)8-11)18-10-16-9-15(18)13-4-3-7-17-13/h9-14,17H,3-8H2,1-2H3
InChIKeyQPLSTBACHRUAAH-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.30
Rot. Bonds2

About 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole

1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole (PubChem CID 114706222) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole.

Molecular Properties

Compound Name1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole
PubChem CID114706222
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole
SMILESCC1CCC(n2cncc2C2CCCN2)C(C)C1
InChIInChI=1S/C15H25N3/c1-11-5-6-14(12(2)8-11)18-10-16-9-15(18)13-4-3-7-17-13/h9-14,17H,3-8H2,1-2H3
InChIKeyQPLSTBACHRUAAH-UHFFFAOYSA-N
XLogP3.30
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole 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

2-[3-(2,4-dimethylcyclohexyl)imidazol-4-yl]piperidine
CID 114706226
3-[3-(2,4-dimethylcyclohexyl)imidazol-4-yl]piperidine
CID 114706230
2-[3-(2,3-dimethylcyclohexyl)imidazol-4-yl]piperidine
CID 114703362
1-cyclopentyl-5-pyrrolidin-2-ylimidazole
CID 114703551
2-[3-(3,4-dimethylcyclohexyl)imidazol-4-yl]piperidine
CID 114706331
2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
CID 114720496
2-methyl-6-[3-(2-methylcyclohexyl)imidazol-4-yl]piperidine
CID 114717087
1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
CID 114704870
1-(2,2-dimethylcyclopentyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104943398
1-propyl-4-(5-pyrrolidin-2-ylimidazol-1-yl)piperidine
CID 114705022
3-(5-piperidin-2-ylimidazol-1-yl)-1-azabicyclo[2.2.2]octane
CID 114703413
1-(2,2-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole
CID 114706666

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole?
The IUPAC name of 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole (CID 114706222) is 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole.
What is the SMILES notation for 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole?
The canonical SMILES for 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole is CC1CCC(n2cncc2C2CCCN2)C(C)C1.
What is the InChIKey of 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole?
The InChIKey is QPLSTBACHRUAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11-5-6-14(12(2)8-11)18-10-16-9-15(18)13-4-3-7-17-13/h9-14,17H,3-8H2,1-2H3.
What are the key properties of 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole?
1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole has a molecular weight of 247.39 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylcyclohexyl)-5-pyrrolidin-2-ylimidazole is sourced from PubChem (CID 114706222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).