5-(methoxymethyl)-1-methylcyclopentene

C8H14O — CID 15570473

IUPAC5-(methoxymethyl)-1-methylcyclopentene
SMILESCOCC1CCC=C1C
InChIInChI=1S/C8H14O/c1-7-4-3-5-8(7)6-9-2/h4,8H,3,5-6H2,1-2H3
InChIKeyLDYGPGTXYUGYGH-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.99
Rot. Bonds2

About 5-(methoxymethyl)-1-methylcyclopentene

5-(methoxymethyl)-1-methylcyclopentene (PubChem CID 15570473) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 5-(methoxymethyl)-1-methylcyclopentene.

Molecular Properties

Compound Name5-(methoxymethyl)-1-methylcyclopentene
PubChem CID15570473
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name5-(methoxymethyl)-1-methylcyclopentene
SMILESCOCC1CCC=C1C
InChIInChI=1S/C8H14O/c1-7-4-3-5-8(7)6-9-2/h4,8H,3,5-6H2,1-2H3
InChIKeyLDYGPGTXYUGYGH-UHFFFAOYSA-N
XLogP1.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 5-(methoxymethyl)-1-methylcyclopentene?
The IUPAC name of 5-(methoxymethyl)-1-methylcyclopentene (CID 15570473) is 5-(methoxymethyl)-1-methylcyclopentene.
What is the SMILES notation for 5-(methoxymethyl)-1-methylcyclopentene?
The canonical SMILES for 5-(methoxymethyl)-1-methylcyclopentene is COCC1CCC=C1C.
What is the InChIKey of 5-(methoxymethyl)-1-methylcyclopentene?
The InChIKey is LDYGPGTXYUGYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-7-4-3-5-8(7)6-9-2/h4,8H,3,5-6H2,1-2H3.
What are the key properties of 5-(methoxymethyl)-1-methylcyclopentene?
5-(methoxymethyl)-1-methylcyclopentene has a molecular weight of 126.20 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-1-methylcyclopentene is sourced from PubChem (CID 15570473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).