5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole

C15H24N2 — CID 10198541

IUPAC5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole
SMILESC(=C\CCC1CCCCC1)\CCc1cnc[nH]1
InChIInChI=1S/C15H24N2/c1(2-7-11-15-12-16-13-17-15)4-8-14-9-5-3-6-10-14/h1-2,12-14H,3-11H2,(H,16,17)/b2-1-
InChIKeyJFGALMNHKIPJOE-UPHRSURJSA-N
MW232.37 g/mol
LogP4.26
Rot. Bonds6

About 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole

5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole (PubChem CID 10198541) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole.

Molecular Properties

Compound Name5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole
PubChem CID10198541
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole
SMILESC(=C\CCC1CCCCC1)\CCc1cnc[nH]1
InChIInChI=1S/C15H24N2/c1(2-7-11-15-12-16-13-17-15)4-8-14-9-5-3-6-10-14/h1-2,12-14H,3-11H2,(H,16,17)/b2-1-
InChIKeyJFGALMNHKIPJOE-UPHRSURJSA-N
XLogP4.26
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole?
The IUPAC name of 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole (CID 10198541) is 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole.
What is the SMILES notation for 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole?
The canonical SMILES for 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole is C(=C\CCC1CCCCC1)\CCc1cnc[nH]1.
What is the InChIKey of 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole?
The InChIKey is JFGALMNHKIPJOE-UPHRSURJSA-N. The full InChI is InChI=1S/C15H24N2/c1(2-7-11-15-12-16-13-17-15)4-8-14-9-5-3-6-10-14/h1-2,12-14H,3-11H2,(H,16,17)/b2-1-.
What are the key properties of 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole?
5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole has a molecular weight of 232.37 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-6-cyclohexylhex-3-enyl]-1H-imidazole is sourced from PubChem (CID 10198541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).