[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane

C14H24O — CID 20816777

IUPAC[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane
SMILESC=C(C)COC(C(=C)C)C1CCCCC1
InChIInChI=1S/C14H24O/c1-11(2)10-15-14(12(3)4)13-8-6-5-7-9-13/h13-14H,1,3,5-10H2,2,4H3
InChIKeyGDQJLIUCCJHCAP-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.10
Rot. Bonds5

About [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane

[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane (PubChem CID 20816777) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane.

Molecular Properties

Compound Name[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane
PubChem CID20816777
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane
SMILESC=C(C)COC(C(=C)C)C1CCCCC1
InChIInChI=1S/C14H24O/c1-11(2)10-15-14(12(3)4)13-8-6-5-7-9-13/h13-14H,1,3,5-10H2,2,4H3
InChIKeyGDQJLIUCCJHCAP-UHFFFAOYSA-N
XLogP4.10
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.10
H-Bond Donors ≤ 50
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 [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane?
The IUPAC name of [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane (CID 20816777) is [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane.
What is the SMILES notation for [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane?
The canonical SMILES for [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane is C=C(C)COC(C(=C)C)C1CCCCC1.
What is the InChIKey of [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane?
The InChIKey is GDQJLIUCCJHCAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-11(2)10-15-14(12(3)4)13-8-6-5-7-9-13/h13-14H,1,3,5-10H2,2,4H3.
What are the key properties of [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane?
[2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane has a molecular weight of 208.34 g/mol, XLogP of 4.10, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-1-(2-methylprop-2-enoxy)prop-2-enyl]cyclohexane is sourced from PubChem (CID 20816777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).