3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane

C15H26O2 — CID 176603255

IUPAC3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane
SMILESCCC1(CCCOC=C2CCCCC2)COC1
InChIInChI=1S/C15H26O2/c1-2-15(12-17-13-15)9-6-10-16-11-14-7-4-3-5-8-14/h11H,2-10,12-13H2,1H3
InChIKeyVYUPVVVUAUHOTN-UHFFFAOYSA-N
MW238.37 g/mol
LogP4.06
Rot. Bonds6

About 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane

3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane (PubChem CID 176603255) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane.

Molecular Properties

Compound Name3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane
PubChem CID176603255
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane
SMILESCCC1(CCCOC=C2CCCCC2)COC1
InChIInChI=1S/C15H26O2/c1-2-15(12-17-13-15)9-6-10-16-11-14-7-4-3-5-8-14/h11H,2-10,12-13H2,1H3
InChIKeyVYUPVVVUAUHOTN-UHFFFAOYSA-N
XLogP4.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 54.06
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

(3Z)-3-(methoxymethylidene)-7-oxaspiro[3.5]nonane
CID 163277602
3-(Methoxymethylidene)-7-oxaspiro[3.5]nonane
CID 163277760
1-(Methoxymethyl)-4-(methoxymethylidene)-1-methylcyclohexane
CID 175004683
3-[3-(Cyclohexylidenemethoxy)propyl]-3-ethyloxolane
CID 176603026
3-(Cyclohexylidenemethoxymethyl)-3-ethyloxane
CID 176603231
4-[2-(Cyclohexylidenemethoxy)ethyl]-4-methyloxane
CID 176603816
3-[3-(Cyclopentylidenemethoxy)propyl]-3-ethyloxetane
CID 176603948
3-Ethyl-3-[3-(2-methylprop-1-enoxy)propyl]oxetane
CID 176604781

Frequently Asked Questions

What is the IUPAC name of 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane?
The IUPAC name of 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane (CID 176603255) is 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane.
What is the SMILES notation for 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane?
The canonical SMILES for 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane is CCC1(CCCOC=C2CCCCC2)COC1.
What is the InChIKey of 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane?
The InChIKey is VYUPVVVUAUHOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-2-15(12-17-13-15)9-6-10-16-11-14-7-4-3-5-8-14/h11H,2-10,12-13H2,1H3.
What are the key properties of 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane?
3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane has a molecular weight of 238.37 g/mol, XLogP of 4.06, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(cyclohexylidenemethoxy)propyl]-3-ethyloxetane is sourced from PubChem (CID 176603255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).