1-(2-methoxycyclopentyl)cyclopentene

C11H18O — CID 166921968

IUPAC1-(2-methoxycyclopentyl)cyclopentene
SMILESCOC1CCCC1C1=CCCC1
InChIInChI=1S/C11H18O/c1-12-11-8-4-7-10(11)9-5-2-3-6-9/h5,10-11H,2-4,6-8H2,1H3
InChIKeyOCDFVBCFOXQOLV-UHFFFAOYSA-N
MW166.26 g/mol
LogP2.91
Rot. Bonds2

About 1-(2-methoxycyclopentyl)cyclopentene

1-(2-methoxycyclopentyl)cyclopentene (PubChem CID 166921968) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 1-(2-methoxycyclopentyl)cyclopentene.

Molecular Properties

Compound Name1-(2-methoxycyclopentyl)cyclopentene
PubChem CID166921968
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name1-(2-methoxycyclopentyl)cyclopentene
SMILESCOC1CCCC1C1=CCCC1
InChIInChI=1S/C11H18O/c1-12-11-8-4-7-10(11)9-5-2-3-6-9/h5,10-11H,2-4,6-8H2,1H3
InChIKeyOCDFVBCFOXQOLV-UHFFFAOYSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 52.91
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 1-(2-methoxycyclopentyl)cyclopentene?
The IUPAC name of 1-(2-methoxycyclopentyl)cyclopentene (CID 166921968) is 1-(2-methoxycyclopentyl)cyclopentene.
What is the SMILES notation for 1-(2-methoxycyclopentyl)cyclopentene?
The canonical SMILES for 1-(2-methoxycyclopentyl)cyclopentene is COC1CCCC1C1=CCCC1.
What is the InChIKey of 1-(2-methoxycyclopentyl)cyclopentene?
The InChIKey is OCDFVBCFOXQOLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c1-12-11-8-4-7-10(11)9-5-2-3-6-9/h5,10-11H,2-4,6-8H2,1H3.
What are the key properties of 1-(2-methoxycyclopentyl)cyclopentene?
1-(2-methoxycyclopentyl)cyclopentene has a molecular weight of 166.26 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxycyclopentyl)cyclopentene is sourced from PubChem (CID 166921968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).