1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane

C14H24O2 — CID 10867945

IUPAC1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane
SMILESC=CCOC1(C(=C)OCC)CCC(C)CC1
InChIInChI=1S/C14H24O2/c1-5-11-16-14(13(4)15-6-2)9-7-12(3)8-10-14/h5,12H,1,4,6-11H2,2-3H3
InChIKeyIIQUGWFWNKHGFE-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.69
Rot. Bonds6

About 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane

1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane (PubChem CID 10867945) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane.

Molecular Properties

Compound Name1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane
PubChem CID10867945
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane
SMILESC=CCOC1(C(=C)OCC)CCC(C)CC1
InChIInChI=1S/C14H24O2/c1-5-11-16-14(13(4)15-6-2)9-7-12(3)8-10-14/h5,12H,1,4,6-11H2,2-3H3
InChIKeyIIQUGWFWNKHGFE-UHFFFAOYSA-N
XLogP3.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Ethenyl-1-(2-methoxyprop-2-enoxy)cyclohexane
CID 13618025
1-Methyl-4-[1-[(2-methylpropan-2-yl)oxy]prop-2-enyl]cyclohexane
CID 70556110
1-Prop-1-enoxy-1-(prop-2-enoxymethyl)cyclohexane
CID 139896285
1-(But-3-en-2-yloxymethyl)-4-(ethenoxymethyl)cyclohexane
CID 144864849
1-[1-(Allyloxy)-2-ethoxy-1-methyl-2-propenyl]-1,4-dimethylcyclohexane
CID 10084296
1-(3-Ethoxy-2-prop-2-enoxybut-3-en-2-yl)-4-methylcyclohexane
CID 10332470
1-Ethenyl-4-methyl-1-propoxycyclohexane
CID 144519084

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane?
The IUPAC name of 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane (CID 10867945) is 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane.
What is the SMILES notation for 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane?
The canonical SMILES for 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane is C=CCOC1(C(=C)OCC)CCC(C)CC1.
What is the InChIKey of 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane?
The InChIKey is IIQUGWFWNKHGFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-5-11-16-14(13(4)15-6-2)9-7-12(3)8-10-14/h5,12H,1,4,6-11H2,2-3H3.
What are the key properties of 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane?
1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane has a molecular weight of 224.34 g/mol, XLogP of 3.69, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxyethenyl)-4-methyl-1-prop-2-enoxycyclohexane is sourced from PubChem (CID 10867945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).