1-ethenyl-4-(2-methoxyethoxy)cyclohexane

C11H20O2 — CID 163469624

IUPAC1-ethenyl-4-(2-methoxyethoxy)cyclohexane
SMILESC=CC1CCC(OCCOC)CC1
InChIInChI=1S/C11H20O2/c1-3-10-4-6-11(7-5-10)13-9-8-12-2/h3,10-11H,1,4-9H2,2H3
InChIKeyBVMMYBMULUTWTG-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.39
Rot. Bonds5

About 1-ethenyl-4-(2-methoxyethoxy)cyclohexane

1-ethenyl-4-(2-methoxyethoxy)cyclohexane (PubChem CID 163469624) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-ethenyl-4-(2-methoxyethoxy)cyclohexane.

Molecular Properties

Compound Name1-ethenyl-4-(2-methoxyethoxy)cyclohexane
PubChem CID163469624
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-ethenyl-4-(2-methoxyethoxy)cyclohexane
SMILESC=CC1CCC(OCCOC)CC1
InChIInChI=1S/C11H20O2/c1-3-10-4-6-11(7-5-10)13-9-8-12-2/h3,10-11H,1,4-9H2,2H3
InChIKeyBVMMYBMULUTWTG-UHFFFAOYSA-N
XLogP2.39
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Vinylcyclohexyl acetate
CID 216426
2,3-Difluoro-1-methyl-4-pent-4-enoxycyclohexane
CID 68216997
1-(1,1-Difluoroethoxy)-4-ethenylcyclohexane
CID 138493518
1-[(E)-2-methoxyethenyl]-4-propoxycyclohexane
CID 20497774
1-[(E)-prop-1-enyl]-4-propoxycyclohexane
CID 20705638
1-hexoxy-4-[(E)-prop-1-enyl]cyclohexane
CID 22095343
2-[(4-Ethenylcyclohexyl)oxymethyl]oxirane
CID 22497822
1,2-Dimethoxy-4-prop-2-enylcyclohexane
CID 44227976
1-Ethenyl-4-methoxycyclohexane
CID 53708771
1-Methoxy-4-prop-1-enylcyclohexane
CID 54215586
1-Prop-1-enyl-4-propoxycyclohexane
CID 54480397
1-Ethenyl-4-(2-methoxypropan-2-yloxy)cyclohexane
CID 54495810

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-(2-methoxyethoxy)cyclohexane?
The IUPAC name of 1-ethenyl-4-(2-methoxyethoxy)cyclohexane (CID 163469624) is 1-ethenyl-4-(2-methoxyethoxy)cyclohexane.
What is the SMILES notation for 1-ethenyl-4-(2-methoxyethoxy)cyclohexane?
The canonical SMILES for 1-ethenyl-4-(2-methoxyethoxy)cyclohexane is C=CC1CCC(OCCOC)CC1.
What is the InChIKey of 1-ethenyl-4-(2-methoxyethoxy)cyclohexane?
The InChIKey is BVMMYBMULUTWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-10-4-6-11(7-5-10)13-9-8-12-2/h3,10-11H,1,4-9H2,2H3.
What are the key properties of 1-ethenyl-4-(2-methoxyethoxy)cyclohexane?
1-ethenyl-4-(2-methoxyethoxy)cyclohexane has a molecular weight of 184.28 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-(2-methoxyethoxy)cyclohexane is sourced from PubChem (CID 163469624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).