3,5-dimethoxy-4-methylcyclopentene

C8H14O2 — CID 18341657

IUPAC3,5-dimethoxy-4-methylcyclopentene
SMILESCOC1C=CC(OC)C1C
InChIInChI=1S/C8H14O2/c1-6-7(9-2)4-5-8(6)10-3/h4-8H,1-3H3
InChIKeyBGMZGYOEZNDBPE-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.22
Rot. Bonds2

About 3,5-dimethoxy-4-methylcyclopentene

3,5-dimethoxy-4-methylcyclopentene (PubChem CID 18341657) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 3,5-dimethoxy-4-methylcyclopentene.

Molecular Properties

Compound Name3,5-dimethoxy-4-methylcyclopentene
PubChem CID18341657
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name3,5-dimethoxy-4-methylcyclopentene
SMILESCOC1C=CC(OC)C1C
InChIInChI=1S/C8H14O2/c1-6-7(9-2)4-5-8(6)10-3/h4-8H,1-3H3
InChIKeyBGMZGYOEZNDBPE-UHFFFAOYSA-N
XLogP1.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-4-methylcyclopentene?
The IUPAC name of 3,5-dimethoxy-4-methylcyclopentene (CID 18341657) is 3,5-dimethoxy-4-methylcyclopentene.
What is the SMILES notation for 3,5-dimethoxy-4-methylcyclopentene?
The canonical SMILES for 3,5-dimethoxy-4-methylcyclopentene is COC1C=CC(OC)C1C.
What is the InChIKey of 3,5-dimethoxy-4-methylcyclopentene?
The InChIKey is BGMZGYOEZNDBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-6-7(9-2)4-5-8(6)10-3/h4-8H,1-3H3.
What are the key properties of 3,5-dimethoxy-4-methylcyclopentene?
3,5-dimethoxy-4-methylcyclopentene has a molecular weight of 142.20 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-4-methylcyclopentene is sourced from PubChem (CID 18341657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).