2-(4-methylidenecyclohexyl)oxyoxane

C12H20O2 — CID 15349885

IUPAC2-(4-methylidenecyclohexyl)oxyoxane
SMILESC=C1CCC(OC2CCCCO2)CC1
InChIInChI=1S/C12H20O2/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h11-12H,1-9H2
InChIKeyLOHAOAJJOLPQBV-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.03
Rot. Bonds2

About 2-(4-methylidenecyclohexyl)oxyoxane

2-(4-methylidenecyclohexyl)oxyoxane (PubChem CID 15349885) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-(4-methylidenecyclohexyl)oxyoxane.

Molecular Properties

Compound Name2-(4-methylidenecyclohexyl)oxyoxane
PubChem CID15349885
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name2-(4-methylidenecyclohexyl)oxyoxane
SMILESC=C1CCC(OC2CCCCO2)CC1
InChIInChI=1S/C12H20O2/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h11-12H,1-9H2
InChIKeyLOHAOAJJOLPQBV-UHFFFAOYSA-N
XLogP3.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-cycloheptyloxyoxane
CID 11735764
2-(oxetan-3-yloxy)oxane
CID 54083112
2-[(1S)-3,4,5,5-tetramethylcyclohex-3-en-1-yl]oxyoxane
CID 57121539
3-(oxan-2-yloxy)cyclobutan-1-ol
CID 155584587
trans-(1R,3R)-2-imino-5-(oxan-2-yloxy)cyclohexane-1,3-diol
CID 89143909
cyclohexyl-[4-(oxan-2-yloxy)cyclohexyl]methanone
CID 140522461
(4S)-4-(oxan-2-yloxy)oxolan-2-one
CID 139705709
(4S)-4-(oxan-2-yloxy)pyrrolidin-2-one
CID 141338293
2-[4-[4-(oxan-2-yloxy)cyclohexyl]phenoxy]oxane
CID 70003262
2-(7-bicyclo[2.2.1]hepta-2,5-dienyloxy)oxane
CID 131843933
(2S)-2-[[(1S,6S)-8-tricyclo[4.3.1.01,6]dec-3-enyl]oxy]oxane
CID 98518565
cis-(1S,2R)-2-[(2S)-oxan-2-yl]oxycyclopropan-1-amine
CID 86316698

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylidenecyclohexyl)oxyoxane?
The IUPAC name of 2-(4-methylidenecyclohexyl)oxyoxane (CID 15349885) is 2-(4-methylidenecyclohexyl)oxyoxane.
What is the SMILES notation for 2-(4-methylidenecyclohexyl)oxyoxane?
The canonical SMILES for 2-(4-methylidenecyclohexyl)oxyoxane is C=C1CCC(OC2CCCCO2)CC1.
What is the InChIKey of 2-(4-methylidenecyclohexyl)oxyoxane?
The InChIKey is LOHAOAJJOLPQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h11-12H,1-9H2.
What are the key properties of 2-(4-methylidenecyclohexyl)oxyoxane?
2-(4-methylidenecyclohexyl)oxyoxane has a molecular weight of 196.29 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylidenecyclohexyl)oxyoxane is sourced from PubChem (CID 15349885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).