2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane

C11H20O2 — CID 15000409

IUPAC2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane
SMILESC=CC1(C)CCC(C(C)(C)OC)O1
InChIInChI=1S/C11H20O2/c1-6-11(4)8-7-9(13-11)10(2,3)12-5/h6,9H,1,7-8H2,2-5H3
InChIKeyYBLBDOWUZVNOKH-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.54
Rot. Bonds3

About 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane

2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane (PubChem CID 15000409) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane.

Molecular Properties

Compound Name2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane
PubChem CID15000409
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane
SMILESC=CC1(C)CCC(C(C)(C)OC)O1
InChIInChI=1S/C11H20O2/c1-6-11(4)8-7-9(13-11)10(2,3)12-5/h6,9H,1,7-8H2,2-5H3
InChIKeyYBLBDOWUZVNOKH-UHFFFAOYSA-N
XLogP2.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane?
The IUPAC name of 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane (CID 15000409) is 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane.
What is the SMILES notation for 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane?
The canonical SMILES for 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane is C=CC1(C)CCC(C(C)(C)OC)O1.
What is the InChIKey of 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane?
The InChIKey is YBLBDOWUZVNOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-6-11(4)8-7-9(13-11)10(2,3)12-5/h6,9H,1,7-8H2,2-5H3.
What are the key properties of 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane?
2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane has a molecular weight of 184.28 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-5-(2-methoxypropan-2-yl)-2-methyloxolane is sourced from PubChem (CID 15000409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).