2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol

C15H26O2 — CID 6429101

IUPAC2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol
SMILESC=CC1(C)CCC(C(C)(O)CCC=C(C)C)O1
InChIInChI=1S/C15H26O2/c1-6-14(4)11-9-13(17-14)15(5,16)10-7-8-12(2)3/h6,8,13,16H,1,7,9-11H2,2-5H3
InChIKeyOIVTVPOJCWXSIC-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.61
Rot. Bonds5

About 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol

2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol (PubChem CID 6429101) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol.

Molecular Properties

Compound Name2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol
PubChem CID6429101
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol
SMILESC=CC1(C)CCC(C(C)(O)CCC=C(C)C)O1
InChIInChI=1S/C15H26O2/c1-6-14(4)11-9-13(17-14)15(5,16)10-7-8-12(2)3/h6,8,13,16H,1,7,9-11H2,2-5H3
InChIKeyOIVTVPOJCWXSIC-UHFFFAOYSA-N
XLogP3.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.61
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 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol?
The IUPAC name of 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol (CID 6429101) is 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol.
What is the SMILES notation for 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol?
The canonical SMILES for 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol is C=CC1(C)CCC(C(C)(O)CCC=C(C)C)O1.
What is the InChIKey of 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol?
The InChIKey is OIVTVPOJCWXSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-6-14(4)11-9-13(17-14)15(5,16)10-7-8-12(2)3/h6,8,13,16H,1,7,9-11H2,2-5H3.
What are the key properties of 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol?
2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol has a molecular weight of 238.37 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethenyl-5-methyloxolan-2-yl)-6-methylhept-5-en-2-ol is sourced from PubChem (CID 6429101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).