2-(cyclopentylidenemethoxymethyl)oxane

C12H20O2 — CID 176603363

IUPAC2-(cyclopentylidenemethoxymethyl)oxane
SMILESC(OCC1CCCCO1)=C1CCCC1
InChIInChI=1S/C12H20O2/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-14-12/h9,12H,1-8,10H2
InChIKeyXOYWOQWPTBBEGJ-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.03
Rot. Bonds3

About 2-(cyclopentylidenemethoxymethyl)oxane

2-(cyclopentylidenemethoxymethyl)oxane (PubChem CID 176603363) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-(cyclopentylidenemethoxymethyl)oxane.

Molecular Properties

Compound Name2-(cyclopentylidenemethoxymethyl)oxane
PubChem CID176603363
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name2-(cyclopentylidenemethoxymethyl)oxane
SMILESC(OCC1CCCCO1)=C1CCCC1
InChIInChI=1S/C12H20O2/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-14-12/h9,12H,1-8,10H2
InChIKeyXOYWOQWPTBBEGJ-UHFFFAOYSA-N
XLogP3.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 53.03
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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Related Compounds

2-(ethoxymethyl)-5-methyl-3,4-dihydro-2H-pyran
CID 70503984
4-(Cyclopentylidenemethoxy)oxane
CID 176603057
3-(Cyclohexylidenemethoxy)oxane
CID 176603061
2-[1-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176603211
2-(Cyclopentylidenemethoxymethyl)-2-methyloxane
CID 176603452
2-(Cyclopentylidenemethoxymethyl)oxepane
CID 176603536
2-(Cyclopentylidenemethoxymethyl)-1,4-dioxane
CID 176603998
2-(Cyclopentylidenemethoxymethyl)oxocane
CID 176604000
2-[2-(Cyclopentylidenemethoxy)ethyl]-1,4-dioxane
CID 176604070
2-[1-(Cyclohexylidenemethoxy)ethyl]oxane
CID 176604355
2-[2-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176604507
3-(Cyclopentylidenemethoxy)oxane
CID 176604530

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylidenemethoxymethyl)oxane?
The IUPAC name of 2-(cyclopentylidenemethoxymethyl)oxane (CID 176603363) is 2-(cyclopentylidenemethoxymethyl)oxane.
What is the SMILES notation for 2-(cyclopentylidenemethoxymethyl)oxane?
The canonical SMILES for 2-(cyclopentylidenemethoxymethyl)oxane is C(OCC1CCCCO1)=C1CCCC1.
What is the InChIKey of 2-(cyclopentylidenemethoxymethyl)oxane?
The InChIKey is XOYWOQWPTBBEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-14-12/h9,12H,1-8,10H2.
What are the key properties of 2-(cyclopentylidenemethoxymethyl)oxane?
2-(cyclopentylidenemethoxymethyl)oxane has a molecular weight of 196.29 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylidenemethoxymethyl)oxane is sourced from PubChem (CID 176603363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).