1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene

C14H20O2 — CID 57175579

IUPAC1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene
SMILESCCC(=COC1=CCCC1)OC1=CCCC1
InChIInChI=1S/C14H20O2/c1-2-12(16-14-9-5-6-10-14)11-15-13-7-3-4-8-13/h7,9,11H,2-6,8,10H2,1H3
InChIKeyBBHKDDIJXVZBII-UHFFFAOYSA-N
MW220.31 g/mol
LogP4.41
Rot. Bonds5

About 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene

1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene (PubChem CID 57175579) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene
PubChem CID57175579
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene
SMILESCCC(=COC1=CCCC1)OC1=CCCC1
InChIInChI=1S/C14H20O2/c1-2-12(16-14-9-5-6-10-14)11-15-13-7-3-4-8-13/h7,9,11H,2-6,8,10H2,1H3
InChIKeyBBHKDDIJXVZBII-UHFFFAOYSA-N
XLogP4.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene?
The IUPAC name of 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene (CID 57175579) is 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene.
What is the SMILES notation for 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene?
The canonical SMILES for 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene is CCC(=COC1=CCCC1)OC1=CCCC1.
What is the InChIKey of 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene?
The InChIKey is BBHKDDIJXVZBII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-2-12(16-14-9-5-6-10-14)11-15-13-7-3-4-8-13/h7,9,11H,2-6,8,10H2,1H3.
What are the key properties of 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene?
1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene has a molecular weight of 220.31 g/mol, XLogP of 4.41, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopenten-1-yloxy)but-1-enoxy]cyclopentene is sourced from PubChem (CID 57175579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).