[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene

C15H20O — CID 10262772

IUPAC[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene
SMILESCO/C=C/C1(c2ccccc2)CCCCC1
InChIInChI=1S/C15H20O/c1-16-13-12-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3/b13-12+
InChIKeyCEDRUWBWYDCNQP-OUKQBFOZSA-N
MW216.32 g/mol
LogP4.05
Rot. Bonds3

About [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene

[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene (PubChem CID 10262772) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene.

Molecular Properties

Compound Name[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene
PubChem CID10262772
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene
SMILESCO/C=C/C1(c2ccccc2)CCCCC1
InChIInChI=1S/C15H20O/c1-16-13-12-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3/b13-12+
InChIKeyCEDRUWBWYDCNQP-OUKQBFOZSA-N
XLogP4.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1-phenylcyclohexane-1-carbaldehyde
CID 14922606
1,1-diphenylcyclotetradecane
CID 175822005
1-(4-methoxyphenyl)cyclohexane-1-carbaldehyde
CID 23587235
(1R)-1-(1-phenylcyclohexyl)ethanamine
CID 78998571
[1-[(1E,3E,5Z)-4-[(2E)-2-ethylidene-4-methylpent-3-enoxy]hepta-1,3,5-trienyl]cyclohexyl]benzene
CID 143134326
(1-dimethoxyphosphorylcyclohexyl)benzene
CID 174740839
ethane;1-phenylcyclohexan-1-ol
CID 144640846
ethane;methanol;(1-phenylcyclohexyl)benzene
CID 91580542
(1R,2S,6R,7S)-1-[(Z)-2-methoxyethenyl]-10,10-dimethyl-7-phenyl-8,9-diazatricyclo[5.2.1.02,6]dec-8-ene
CID 10661647
1-phenylcyclohexane-1-thiol
CID 19348891
1-phenylcyclopropane-1-carbaldehyde
CID 11008055
methane;(1-methylcyclopentyl)benzene
CID 143499824

Frequently Asked Questions

What is the IUPAC name of [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene?
The IUPAC name of [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene (CID 10262772) is [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene.
What is the SMILES notation for [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene?
The canonical SMILES for [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene is CO/C=C/C1(c2ccccc2)CCCCC1.
What is the InChIKey of [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene?
The InChIKey is CEDRUWBWYDCNQP-OUKQBFOZSA-N. The full InChI is InChI=1S/C15H20O/c1-16-13-12-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3/b13-12+.
What are the key properties of [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene?
[1-[(E)-2-methoxyethenyl]cyclohexyl]benzene has a molecular weight of 216.32 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(E)-2-methoxyethenyl]cyclohexyl]benzene is sourced from PubChem (CID 10262772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).