1-ethyl-4-(2-methoxyethenyl)cyclohexane

C11H20O — CID 91328086

IUPAC1-ethyl-4-(2-methoxyethenyl)cyclohexane
SMILESCCC1CCC(C=COC)CC1
InChIInChI=1S/C11H20O/c1-3-10-4-6-11(7-5-10)8-9-12-2/h8-11H,3-7H2,1-2H3
InChIKeyNWSVXXIARYOMMR-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.36
Rot. Bonds3

About 1-ethyl-4-(2-methoxyethenyl)cyclohexane

1-ethyl-4-(2-methoxyethenyl)cyclohexane (PubChem CID 91328086) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-ethyl-4-(2-methoxyethenyl)cyclohexane.

Molecular Properties

Compound Name1-ethyl-4-(2-methoxyethenyl)cyclohexane
PubChem CID91328086
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-ethyl-4-(2-methoxyethenyl)cyclohexane
SMILESCCC1CCC(C=COC)CC1
InChIInChI=1S/C11H20O/c1-3-10-4-6-11(7-5-10)8-9-12-2/h8-11H,3-7H2,1-2H3
InChIKeyNWSVXXIARYOMMR-UHFFFAOYSA-N
XLogP3.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.36
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-ethyl-4-[2-(4-ethylcyclohexyl)ethenyl]cyclohexane
CID 140739356
1-(2-methoxyethenyl)-4-[(E)-pent-1-enyl]cyclohexane
CID 67570226
1-(2-bromoethenyl)-4-ethylcyclohexane
CID 173341809
1-ethyl-4-[(E)-prop-1-enyl]cyclohexane
CID 59981886
4-(2-methoxyethenyl)cyclohexane-1-carbonitrile
CID 70406257
1-ethyl-4-[(E)-2-[4-(trifluoromethyl)cyclohexyl]ethenyl]cyclohexane
CID 101139962
azane;ethylcyclopropane
CID 20975579
ethane;ethylcyclopropane
CID 91380076
ethane;4-ethylcyclohexane-1-carbaldehyde
CID 145257925
1-ethyl-4-[(E)-4-(4-prop-1-enylcyclohexyl)but-1-enyl]cyclohexane
CID 173282061
1-ethyl-4-[(E)-4-[4-[(E)-pent-3-enyl]cyclohexyl]but-1-enyl]cyclohexane
CID 19070206
4-(4-ethylcyclohexyl)cyclohexane-1-carbaldehyde
CID 15430928

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(2-methoxyethenyl)cyclohexane?
The IUPAC name of 1-ethyl-4-(2-methoxyethenyl)cyclohexane (CID 91328086) is 1-ethyl-4-(2-methoxyethenyl)cyclohexane.
What is the SMILES notation for 1-ethyl-4-(2-methoxyethenyl)cyclohexane?
The canonical SMILES for 1-ethyl-4-(2-methoxyethenyl)cyclohexane is CCC1CCC(C=COC)CC1.
What is the InChIKey of 1-ethyl-4-(2-methoxyethenyl)cyclohexane?
The InChIKey is NWSVXXIARYOMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-3-10-4-6-11(7-5-10)8-9-12-2/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-ethyl-4-(2-methoxyethenyl)cyclohexane?
1-ethyl-4-(2-methoxyethenyl)cyclohexane has a molecular weight of 168.28 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(2-methoxyethenyl)cyclohexane is sourced from PubChem (CID 91328086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).