2-[3-(cyclohexylidenemethoxy)propyl]oxolane

C14H24O2 — CID 176603711

IUPAC2-[3-(cyclohexylidenemethoxy)propyl]oxolane
SMILESC(OCCCC1CCCO1)=C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-10-4-8-14-9-5-11-16-14/h12,14H,1-11H2
InChIKeyJQSOCFXWNMASEP-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.81
Rot. Bonds5

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

2-[3-(cyclohexylidenemethoxy)propyl]oxolane (PubChem CID 176603711) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-[3-(cyclohexylidenemethoxy)propyl]oxolane.

Molecular Properties

Compound Name2-[3-(cyclohexylidenemethoxy)propyl]oxolane
PubChem CID176603711
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-[3-(cyclohexylidenemethoxy)propyl]oxolane
SMILESC(OCCCC1CCCO1)=C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-10-4-8-14-9-5-11-16-14/h12,14H,1-11H2
InChIKeyJQSOCFXWNMASEP-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
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

1-Ethoxy-4-(methoxymethylidene)cyclohexane
CID 118366710
3-(Cyclohexylidenemethoxy)oxocane
CID 176603020
2-[3-(Cyclohexylidenemethoxy)propyl]oxocane
CID 176603505
2-[3-(2-Methylprop-1-enoxy)propyl]oxolane
CID 176603913
2-[2-(Cyclohexylidenemethoxy)ethyl]oxane
CID 176604143
2-[3-(Cyclopentylidenemethoxy)propyl]oxolane
CID 176604433
2-[2-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176604507
2-[3-(Cyclopentylidenemethoxy)propyl]oxane
CID 176604570
2-[2-(Cyclohexylidenemethoxy)ethyl]oxolane
CID 176604877
2-[3-(Cyclohexylidenemethoxy)propyl]-2-ethyloxolane
CID 176604907
2-[3-(Cyclohexylidenemethoxy)propyl]oxane
CID 176605196
2-(Cyclohexylidenemethoxymethyl)oxepane
CID 176605291

Frequently Asked Questions

What is the IUPAC name of 2-[3-(cyclohexylidenemethoxy)propyl]oxolane?
The IUPAC name of 2-[3-(cyclohexylidenemethoxy)propyl]oxolane (CID 176603711) is 2-[3-(cyclohexylidenemethoxy)propyl]oxolane.
What is the SMILES notation for 2-[3-(cyclohexylidenemethoxy)propyl]oxolane?
The canonical SMILES for 2-[3-(cyclohexylidenemethoxy)propyl]oxolane is C(OCCCC1CCCO1)=C1CCCCC1.
What is the InChIKey of 2-[3-(cyclohexylidenemethoxy)propyl]oxolane?
The InChIKey is JQSOCFXWNMASEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-10-4-8-14-9-5-11-16-14/h12,14H,1-11H2.
What are the key properties of 2-[3-(cyclohexylidenemethoxy)propyl]oxolane?
2-[3-(cyclohexylidenemethoxy)propyl]oxolane has a molecular weight of 224.34 g/mol, XLogP of 3.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(cyclohexylidenemethoxy)propyl]oxolane is sourced from PubChem (CID 176603711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).