2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane

C14H24O2 — CID 176603490

IUPAC2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane
SMILESCC1(CCOC=C2CCCC2)CCCCO1
InChIInChI=1S/C14H24O2/c1-14(8-4-5-10-16-14)9-11-15-12-13-6-2-3-7-13/h12H,2-11H2,1H3
InChIKeyOHVWVISZVGIFDF-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.81
Rot. Bonds4

About 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane

2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane (PubChem CID 176603490) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane.

Molecular Properties

Compound Name2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane
PubChem CID176603490
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane
SMILESCC1(CCOC=C2CCCC2)CCCCO1
InChIInChI=1S/C14H24O2/c1-14(8-4-5-10-16-14)9-11-15-12-13-6-2-3-7-13/h12H,2-11H2,1H3
InChIKeyOHVWVISZVGIFDF-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.81
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

2H-Pyran, 2-ethyltetrahydro-2-methyl-4-methylene-
CID 12283094
2,2-Diethyl-4-methylideneoxane
CID 12338278
9-Methylidene-6-oxaspiro[4.5]decane
CID 12338281
4-(methoxymethylene)-2,2,6,6-tetramethyltetrahydro-2H-pyran
CID 58424367
(Z)-4-(MethoxyMethylene)-2,2-diMethyltetrahydro-2H-pyran
CID 91827950
(4E)-4-(methoxymethylidene)-2,2-dimethyloxane
CID 117759949
4-(methoxymethylene)-2,2-dimethyltetrahydro-2H-pyran
CID 130851574
3-Prop-1-en-2-yl-1,8-dioxaspiro[4.5]decane
CID 169746673
(3S)-3-prop-1-en-2-yl-1,8-dioxaspiro[4.5]decane
CID 170034190
2-(Cyclopentylidenemethoxymethyl)-2-methyloxane
CID 176603452
2-[2-(Cyclopentylidenemethoxy)ethyl]-2-methyloxolane
CID 176603910
2-Methyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxane
CID 176604335

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane?
The IUPAC name of 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane (CID 176603490) is 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane.
What is the SMILES notation for 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane?
The canonical SMILES for 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane is CC1(CCOC=C2CCCC2)CCCCO1.
What is the InChIKey of 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane?
The InChIKey is OHVWVISZVGIFDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-14(8-4-5-10-16-14)9-11-15-12-13-6-2-3-7-13/h12H,2-11H2,1H3.
What are the key properties of 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane?
2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane has a molecular weight of 224.34 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylidenemethoxy)ethyl]-2-methyloxane is sourced from PubChem (CID 176603490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).