3-decyl-1,2-dihydroimidazole

C13H26N2 — CID 23187945

IUPAC3-decyl-1,2-dihydroimidazole
SMILESCCCCCCCCCCN1C=CNC1
InChIInChI=1S/C13H26N2/c1-2-3-4-5-6-7-8-9-11-15-12-10-14-13-15/h10,12,14H,2-9,11,13H2,1H3
InChIKeyOAYYKPVBFJNKIX-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.46
Rot. Bonds9

About 3-decyl-1,2-dihydroimidazole

3-decyl-1,2-dihydroimidazole (PubChem CID 23187945) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-decyl-1,2-dihydroimidazole.

Molecular Properties

Compound Name3-decyl-1,2-dihydroimidazole
PubChem CID23187945
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name3-decyl-1,2-dihydroimidazole
SMILESCCCCCCCCCCN1C=CNC1
InChIInChI=1S/C13H26N2/c1-2-3-4-5-6-7-8-9-11-15-12-10-14-13-15/h10,12,14H,2-9,11,13H2,1H3
InChIKeyOAYYKPVBFJNKIX-UHFFFAOYSA-N
XLogP3.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-decyl-1,2-dihydroimidazole 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 3-decyl-1,2-dihydroimidazole?
The IUPAC name of 3-decyl-1,2-dihydroimidazole (CID 23187945) is 3-decyl-1,2-dihydroimidazole.
What is the SMILES notation for 3-decyl-1,2-dihydroimidazole?
The canonical SMILES for 3-decyl-1,2-dihydroimidazole is CCCCCCCCCCN1C=CNC1.
What is the InChIKey of 3-decyl-1,2-dihydroimidazole?
The InChIKey is OAYYKPVBFJNKIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-3-4-5-6-7-8-9-11-15-12-10-14-13-15/h10,12,14H,2-9,11,13H2,1H3.
What are the key properties of 3-decyl-1,2-dihydroimidazole?
3-decyl-1,2-dihydroimidazole has a molecular weight of 210.36 g/mol, XLogP of 3.46, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-decyl-1,2-dihydroimidazole is sourced from PubChem (CID 23187945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).