2-[3-(cyclopentylidenemethoxy)propyl]oxolane

C13H22O2 — CID 176604433

IUPAC2-[3-(cyclopentylidenemethoxy)propyl]oxolane
SMILESC(OCCCC1CCCO1)=C1CCCC1
InChIInChI=1S/C13H22O2/c1-2-6-12(5-1)11-14-9-3-7-13-8-4-10-15-13/h11,13H,1-10H2
InChIKeyPJSLEFSKUVAKOB-UHFFFAOYSA-N
MW210.32 g/mol
LogP3.42
Rot. Bonds5

About 2-[3-(cyclopentylidenemethoxy)propyl]oxolane

2-[3-(cyclopentylidenemethoxy)propyl]oxolane (PubChem CID 176604433) has the molecular formula C13H22O2 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-[3-(cyclopentylidenemethoxy)propyl]oxolane.

Molecular Properties

Compound Name2-[3-(cyclopentylidenemethoxy)propyl]oxolane
PubChem CID176604433
Molecular FormulaC13H22O2
Molecular Weight210.32 g/mol
Exact Mass210.16
IUPAC Name2-[3-(cyclopentylidenemethoxy)propyl]oxolane
SMILESC(OCCCC1CCCO1)=C1CCCC1
InChIInChI=1S/C13H22O2/c1-2-6-12(5-1)11-14-9-3-7-13-8-4-10-15-13/h11,13H,1-10H2
InChIKeyPJSLEFSKUVAKOB-UHFFFAOYSA-N
XLogP3.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(Oxolan-2-yl)-2,3-dihydrofuran
CID 20504360
2-(Cyclopentylidenemethoxymethyl)oxepane
CID 176603536
2-[3-(Cyclohexylidenemethoxy)propyl]oxolane
CID 176603711
2-[3-(2-Methylprop-1-enoxy)propyl]oxolane
CID 176603913
2-[2-(Cyclopentylidenemethoxy)ethyl]oxolane
CID 176604066
2-[2-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176604507
2-[3-(Cyclopentylidenemethoxy)propyl]oxane
CID 176604570
2-[3-(Cyclopentylidenemethoxy)propyl]-2-ethyloxolane
CID 176604620
2-[3-(Cyclopentylidenemethoxy)propyl]oxocane
CID 176605202
3-(Cyclopentylidenemethoxy)oxocane
CID 176605259
2-[(E)-3-methoxy-2-methylprop-2-enyl]oxolane
CID 10678486
2-[(E)-3-ethoxy-2-methylprop-2-enyl]oxolane
CID 10821052

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclopentylidenemethoxy)propyl]oxolane?
The IUPAC name of 2-[3-(cyclopentylidenemethoxy)propyl]oxolane (CID 176604433) is 2-[3-(cyclopentylidenemethoxy)propyl]oxolane.
What is the SMILES notation for 2-[3-(cyclopentylidenemethoxy)propyl]oxolane?
The canonical SMILES for 2-[3-(cyclopentylidenemethoxy)propyl]oxolane is C(OCCCC1CCCO1)=C1CCCC1.
What is the InChIKey of 2-[3-(cyclopentylidenemethoxy)propyl]oxolane?
The InChIKey is PJSLEFSKUVAKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2/c1-2-6-12(5-1)11-14-9-3-7-13-8-4-10-15-13/h11,13H,1-10H2.
What are the key properties of 2-[3-(cyclopentylidenemethoxy)propyl]oxolane?
2-[3-(cyclopentylidenemethoxy)propyl]oxolane has a molecular weight of 210.32 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclopentylidenemethoxy)propyl]oxolane is sourced from PubChem (CID 176604433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).