1-ethenyl-5-(methoxymethoxy)cyclohexene

C10H16O2 — CID 101021221

IUPAC1-ethenyl-5-(methoxymethoxy)cyclohexene
SMILESC=CC1=CCCC(OCOC)C1
InChIInChI=1S/C10H16O2/c1-3-9-5-4-6-10(7-9)12-8-11-2/h3,5,10H,1,4,6-8H2,2H3
InChIKeyMPGSCMULPSLRHM-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.27
Rot. Bonds4

About 1-ethenyl-5-(methoxymethoxy)cyclohexene

1-ethenyl-5-(methoxymethoxy)cyclohexene (PubChem CID 101021221) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 1-ethenyl-5-(methoxymethoxy)cyclohexene.

Molecular Properties

Compound Name1-ethenyl-5-(methoxymethoxy)cyclohexene
PubChem CID101021221
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name1-ethenyl-5-(methoxymethoxy)cyclohexene
SMILESC=CC1=CCCC(OCOC)C1
InChIInChI=1S/C10H16O2/c1-3-9-5-4-6-10(7-9)12-8-11-2/h3,5,10H,1,4,6-8H2,2H3
InChIKeyMPGSCMULPSLRHM-UHFFFAOYSA-N
XLogP2.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-ethenyl-5-methylcyclohexene
CID 13382650
(5R,6S)-1-ethenyl-6-(methoxymethoxy)-5-methylcyclohexene
CID 125476026
(6R)-1-ethenyl-6-(methoxymethoxy)cyclohexene
CID 100956688
(3S)-1-ethenyl-3-(methoxymethoxy)cyclohexene
CID 100956681
1-[1-[(5S)-5-(methoxymethoxy)cyclohexen-1-yl]cyclopentyl]pentan-1-one
CID 134231806
(3-ethenylcyclobut-2-en-1-yl)methoxycyclohexane
CID 142510870
[(1R,2S,4S)-2-ethenyl-4-(methoxymethoxy)cyclopentyl]methanol
CID 10943185
cis-(2R,4R)-4-(methoxymethoxy)-2-prop-2-enylcyclohexan-1-one
CID 124635148
cis-(2S,4S)-4-(methoxymethoxy)-2-prop-2-enylcyclohexan-1-one
CID 124635151
(5S)-5-(methoxymethoxy)cyclohex-2-en-1-one
CID 11686945
(8R,9R,10R,13S,14S)-3-(methoxymethoxy)-10,13,17-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
CID 70602264
3-(methoxymethoxy)cyclopentan-1-ol
CID 91618356

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-5-(methoxymethoxy)cyclohexene?
The IUPAC name of 1-ethenyl-5-(methoxymethoxy)cyclohexene (CID 101021221) is 1-ethenyl-5-(methoxymethoxy)cyclohexene.
What is the SMILES notation for 1-ethenyl-5-(methoxymethoxy)cyclohexene?
The canonical SMILES for 1-ethenyl-5-(methoxymethoxy)cyclohexene is C=CC1=CCCC(OCOC)C1.
What is the InChIKey of 1-ethenyl-5-(methoxymethoxy)cyclohexene?
The InChIKey is MPGSCMULPSLRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-3-9-5-4-6-10(7-9)12-8-11-2/h3,5,10H,1,4,6-8H2,2H3.
What are the key properties of 1-ethenyl-5-(methoxymethoxy)cyclohexene?
1-ethenyl-5-(methoxymethoxy)cyclohexene has a molecular weight of 168.24 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-5-(methoxymethoxy)cyclohexene is sourced from PubChem (CID 101021221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).