4-[3-(cyclohexylidenemethoxy)propyl]oxane

C15H26O2 — CID 176605226

IUPAC4-[3-(cyclohexylidenemethoxy)propyl]oxane
SMILESC(OCCCC1CCOCC1)=C1CCCCC1
InChIInChI=1S/C15H26O2/c1-2-5-15(6-3-1)13-17-10-4-7-14-8-11-16-12-9-14/h13-14H,1-12H2
InChIKeyUDMDWHIXLLIPGU-UHFFFAOYSA-N
MW238.37 g/mol
LogP4.06
Rot. Bonds5

About 4-[3-(cyclohexylidenemethoxy)propyl]oxane

4-[3-(cyclohexylidenemethoxy)propyl]oxane (PubChem CID 176605226) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-[3-(cyclohexylidenemethoxy)propyl]oxane.

Molecular Properties

Compound Name4-[3-(cyclohexylidenemethoxy)propyl]oxane
PubChem CID176605226
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name4-[3-(cyclohexylidenemethoxy)propyl]oxane
SMILESC(OCCCC1CCOCC1)=C1CCCCC1
InChIInChI=1S/C15H26O2/c1-2-5-15(6-3-1)13-17-10-4-7-14-8-11-16-12-9-14/h13-14H,1-12H2
InChIKeyUDMDWHIXLLIPGU-UHFFFAOYSA-N
XLogP4.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
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

1-(Methoxymethyl)-4-(methoxymethylidene)cyclohexane
CID 139615355
4-(2-Methylprop-2-enyl)oxane
CID 145466490
5-[(2S)-1-(oxan-4-yliodanuidyl)propan-2-yl]-3,4-dihydro-2H-pyran
CID 163590391
4-[1-(Cyclohexylidenemethoxy)ethyl]oxane
CID 176602976
3-(Cyclohexylidenemethoxymethyl)-3-ethyloxane
CID 176603231
4-[3-(Cyclohexylidenemethoxy)propyl]-4-ethyloxane
CID 176603273
4-[2-(Cyclohexylidenemethoxy)ethyl]-3-methyloxane
CID 176603426
4-[3-(2-Methylprop-1-enoxy)propyl]oxane
CID 176603549
3-(Cyclohexylidenemethoxymethyl)oxane
CID 176604204
3-[2-(Cyclohexylidenemethoxy)ethyl]oxane
CID 176604253
4-(Cyclohexylidenemethoxymethyl)oxane
CID 176604614
3-[3-(Cyclohexylidenemethoxy)propyl]oxolane
CID 176604799

Frequently Asked Questions

What is the IUPAC name of 4-[3-(cyclohexylidenemethoxy)propyl]oxane?
The IUPAC name of 4-[3-(cyclohexylidenemethoxy)propyl]oxane (CID 176605226) is 4-[3-(cyclohexylidenemethoxy)propyl]oxane.
What is the SMILES notation for 4-[3-(cyclohexylidenemethoxy)propyl]oxane?
The canonical SMILES for 4-[3-(cyclohexylidenemethoxy)propyl]oxane is C(OCCCC1CCOCC1)=C1CCCCC1.
What is the InChIKey of 4-[3-(cyclohexylidenemethoxy)propyl]oxane?
The InChIKey is UDMDWHIXLLIPGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-2-5-15(6-3-1)13-17-10-4-7-14-8-11-16-12-9-14/h13-14H,1-12H2.
What are the key properties of 4-[3-(cyclohexylidenemethoxy)propyl]oxane?
4-[3-(cyclohexylidenemethoxy)propyl]oxane has a molecular weight of 238.37 g/mol, XLogP of 4.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(cyclohexylidenemethoxy)propyl]oxane is sourced from PubChem (CID 176605226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).