1-(2-cyclooctylethenyl)imidazole

C13H20N2 — CID 57177175

IUPAC1-(2-cyclooctylethenyl)imidazole
SMILESC(=Cn1ccnc1)C1CCCCCCC1
InChIInChI=1S/C13H20N2/c1-2-4-6-13(7-5-3-1)8-10-15-11-9-14-12-15/h8-13H,1-7H2
InChIKeyUNQXKXMODQTBQB-UHFFFAOYSA-N
MW204.32 g/mol
LogP3.71
Rot. Bonds2

About 1-(2-cyclooctylethenyl)imidazole

1-(2-cyclooctylethenyl)imidazole (PubChem CID 57177175) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-(2-cyclooctylethenyl)imidazole.

Molecular Properties

Compound Name1-(2-cyclooctylethenyl)imidazole
PubChem CID57177175
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-(2-cyclooctylethenyl)imidazole
SMILESC(=Cn1ccnc1)C1CCCCCCC1
InChIInChI=1S/C13H20N2/c1-2-4-6-13(7-5-3-1)8-10-15-11-9-14-12-15/h8-13H,1-7H2
InChIKeyUNQXKXMODQTBQB-UHFFFAOYSA-N
XLogP3.71
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-penta-1,4-dienylimidazole
CID 66665708
2-cyclohexylethenylcyclohexane
CID 4124459
1-cyclopentyl-N-imidazol-1-yloxymethanimine
CID 54463759
imidazol-1-ylmethylidenetungsten
CID 155786244
imidazole-1-carbaldehyde
CID 11083832
1-(cyclooctylmethyl)imidazole
CID 20550238
tetrakis(1-ethenylimidazole);tetrahydrofluoride
CID 173041654
1-[(E)-2-phenylethenyl]imidazole
CID 5374234
1-(1-cyclohexylethyl)imidazole
CID 20574506
1-[[(1R,2S)-2-(imidazol-1-ylmethyl)cyclohexyl]methyl]imidazole
CID 118636677
4-(2-cyclohexylethenyl)morpholine
CID 54339222
magnesium;1-ethenylimidazole;hydride;hydrochloride
CID 174736374

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclooctylethenyl)imidazole?
The IUPAC name of 1-(2-cyclooctylethenyl)imidazole (CID 57177175) is 1-(2-cyclooctylethenyl)imidazole.
What is the SMILES notation for 1-(2-cyclooctylethenyl)imidazole?
The canonical SMILES for 1-(2-cyclooctylethenyl)imidazole is C(=Cn1ccnc1)C1CCCCCCC1.
What is the InChIKey of 1-(2-cyclooctylethenyl)imidazole?
The InChIKey is UNQXKXMODQTBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-2-4-6-13(7-5-3-1)8-10-15-11-9-14-12-15/h8-13H,1-7H2.
What are the key properties of 1-(2-cyclooctylethenyl)imidazole?
1-(2-cyclooctylethenyl)imidazole has a molecular weight of 204.32 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclooctylethenyl)imidazole is sourced from PubChem (CID 57177175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).