2-(2-iodocyclopent-2-en-1-yl)oxyoxane

C10H15IO2 — CID 118540500

IUPAC2-(2-iodocyclopent-2-en-1-yl)oxyoxane
SMILESIC1=CCCC1OC1CCCCO1
InChIInChI=1S/C10H15IO2/c11-8-4-3-5-9(8)13-10-6-1-2-7-12-10/h4,9-10H,1-3,5-7H2
InChIKeyHNFTVVWRMXAEHL-UHFFFAOYSA-N
MW294.13 g/mol
LogP3.01
Rot. Bonds2

About 2-(2-iodocyclopent-2-en-1-yl)oxyoxane

2-(2-iodocyclopent-2-en-1-yl)oxyoxane (PubChem CID 118540500) has the molecular formula C10H15IO2 and a molecular weight of 294.13 g/mol. Its IUPAC name is 2-(2-iodocyclopent-2-en-1-yl)oxyoxane.

Molecular Properties

Compound Name2-(2-iodocyclopent-2-en-1-yl)oxyoxane
PubChem CID118540500
Molecular FormulaC10H15IO2
Molecular Weight294.13 g/mol
Exact Mass294.01
IUPAC Name2-(2-iodocyclopent-2-en-1-yl)oxyoxane
SMILESIC1=CCCC1OC1CCCCO1
InChIInChI=1S/C10H15IO2/c11-8-4-3-5-9(8)13-10-6-1-2-7-12-10/h4,9-10H,1-3,5-7H2
InChIKeyHNFTVVWRMXAEHL-UHFFFAOYSA-N
XLogP3.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.13
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-iodocyclopent-2-en-1-yl)oxyoxane?
The IUPAC name of 2-(2-iodocyclopent-2-en-1-yl)oxyoxane (CID 118540500) is 2-(2-iodocyclopent-2-en-1-yl)oxyoxane.
What is the SMILES notation for 2-(2-iodocyclopent-2-en-1-yl)oxyoxane?
The canonical SMILES for 2-(2-iodocyclopent-2-en-1-yl)oxyoxane is IC1=CCCC1OC1CCCCO1.
What is the InChIKey of 2-(2-iodocyclopent-2-en-1-yl)oxyoxane?
The InChIKey is HNFTVVWRMXAEHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15IO2/c11-8-4-3-5-9(8)13-10-6-1-2-7-12-10/h4,9-10H,1-3,5-7H2.
What are the key properties of 2-(2-iodocyclopent-2-en-1-yl)oxyoxane?
2-(2-iodocyclopent-2-en-1-yl)oxyoxane has a molecular weight of 294.13 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iodocyclopent-2-en-1-yl)oxyoxane is sourced from PubChem (CID 118540500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).