5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol

C11H20O2 — CID 15146944

IUPAC5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol
SMILESCC(C)=CCCC1(C)CCC(O)O1
InChIInChI=1S/C11H20O2/c1-9(2)5-4-7-11(3)8-6-10(12)13-11/h5,10,12H,4,6-8H2,1-3H3
InChIKeyXMUFJLLRDCVSDT-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.62
Rot. Bonds3

About 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol

5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol (PubChem CID 15146944) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol.

Molecular Properties

Compound Name5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol
PubChem CID15146944
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol
SMILESCC(C)=CCCC1(C)CCC(O)O1
InChIInChI=1S/C11H20O2/c1-9(2)5-4-7-11(3)8-6-10(12)13-11/h5,10,12H,4,6-8H2,1-3H3
InChIKeyXMUFJLLRDCVSDT-UHFFFAOYSA-N
XLogP2.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.62
H-Bond Donors ≤ 51
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 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol?
The IUPAC name of 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol (CID 15146944) is 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol.
What is the SMILES notation for 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol?
The canonical SMILES for 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol is CC(C)=CCCC1(C)CCC(O)O1.
What is the InChIKey of 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol?
The InChIKey is XMUFJLLRDCVSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-9(2)5-4-7-11(3)8-6-10(12)13-11/h5,10,12H,4,6-8H2,1-3H3.
What are the key properties of 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol?
5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol has a molecular weight of 184.28 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-(4-methylpent-3-enyl)oxolan-2-ol is sourced from PubChem (CID 15146944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).