1-(5-ethyloctan-3-yl)imidazole

C13H24N2 — CID 140807284

IUPAC1-(5-ethyloctan-3-yl)imidazole
SMILESCCCC(CC)CC(CC)n1ccnc1
InChIInChI=1S/C13H24N2/c1-4-7-12(5-2)10-13(6-3)15-9-8-14-11-15/h8-9,11-13H,4-7,10H2,1-3H3
InChIKeyOFHIDEPGDSZYIT-UHFFFAOYSA-N
MW208.35 g/mol
LogP4.05
Rot. Bonds7

About 1-(5-ethyloctan-3-yl)imidazole

1-(5-ethyloctan-3-yl)imidazole (PubChem CID 140807284) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-(5-ethyloctan-3-yl)imidazole.

Molecular Properties

Compound Name1-(5-ethyloctan-3-yl)imidazole
PubChem CID140807284
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name1-(5-ethyloctan-3-yl)imidazole
SMILESCCCC(CC)CC(CC)n1ccnc1
InChIInChI=1S/C13H24N2/c1-4-7-12(5-2)10-13(6-3)15-9-8-14-11-15/h8-9,11-13H,4-7,10H2,1-3H3
InChIKeyOFHIDEPGDSZYIT-UHFFFAOYSA-N
XLogP4.05
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(5-ethyloctan-3-yl)imidazole 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

1-hexan-3-ylimidazole
CID 54145075
1-heptan-3-ylimidazole;hydrobromide
CID 174803482
1-octadecan-4-ylimidazole
CID 174516132
1-imidazol-1-ylbutane-1-thiol
CID 135238655
1-docosan-5-ylimidazole
CID 135305816
1-hex-5-en-3-ylimidazole
CID 121330081
1-(1-methoxybutyl)imidazole
CID 118061867
2-imidazol-1-yl-N-(2-methylpropyl)butan-1-amine
CID 62448325
1-(4-ethylphenyl)-3-imidazol-1-ylpentan-1-amine
CID 57282349
3-imidazol-1-ylhexan-2-ol
CID 174552394
N-[[[4,6-di(imidazol-1-yl)-2-methyloctanoyl]amino]methyl]-4,6-di(imidazol-1-yl)-2-methyloctanamide
CID 176729128
3-imidazol-1-yldodecan-1-ol
CID 174685778

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyloctan-3-yl)imidazole?
The IUPAC name of 1-(5-ethyloctan-3-yl)imidazole (CID 140807284) is 1-(5-ethyloctan-3-yl)imidazole.
What is the SMILES notation for 1-(5-ethyloctan-3-yl)imidazole?
The canonical SMILES for 1-(5-ethyloctan-3-yl)imidazole is CCCC(CC)CC(CC)n1ccnc1.
What is the InChIKey of 1-(5-ethyloctan-3-yl)imidazole?
The InChIKey is OFHIDEPGDSZYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-7-12(5-2)10-13(6-3)15-9-8-14-11-15/h8-9,11-13H,4-7,10H2,1-3H3.
What are the key properties of 1-(5-ethyloctan-3-yl)imidazole?
1-(5-ethyloctan-3-yl)imidazole has a molecular weight of 208.35 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyloctan-3-yl)imidazole is sourced from PubChem (CID 140807284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).