4-(methoxymethyl)-4-methylcyclopentene

C8H14O — CID 59888767

IUPAC4-(methoxymethyl)-4-methylcyclopentene
SMILESCOCC1(C)CC=CC1
InChIInChI=1S/C8H14O/c1-8(7-9-2)5-3-4-6-8/h3-4H,5-7H2,1-2H3
InChIKeyYEVUTJQYBGLJSL-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.99
Rot. Bonds2

About 4-(methoxymethyl)-4-methylcyclopentene

4-(methoxymethyl)-4-methylcyclopentene (PubChem CID 59888767) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 4-(methoxymethyl)-4-methylcyclopentene.

Molecular Properties

Compound Name4-(methoxymethyl)-4-methylcyclopentene
PubChem CID59888767
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name4-(methoxymethyl)-4-methylcyclopentene
SMILESCOCC1(C)CC=CC1
InChIInChI=1S/C8H14O/c1-8(7-9-2)5-3-4-6-8/h3-4H,5-7H2,1-2H3
InChIKeyYEVUTJQYBGLJSL-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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Related Compounds

(1-(Methoxymethyl)cyclopent-3-en-1-yl)methanol
CID 53753373
4-(Methoxymethyl)cyclopent-1-ene
CID 122164129
[1-(Prop-2-en-1-yl)cyclopent-3-en-1-yl]methanol
CID 137699043
4-(2-Methoxyethyl)cyclopentene
CID 118394373
(1-Methylcyclopent-3-en-1-yl)methanol
CID 59888749
3-[(E)-2-methoxyethenyl]-3,4,4-trimethylcyclopentene
CID 44195648
5,5-Bis(methoxymethyl)-2,8-dimethylnona-2,7-diene
CID 19985381
4-methyl-4-[(E)-prop-1-enyl]oxane
CID 57602871
3-methyl-3-[(Z)-5-methylhex-2-enyl]oxolane
CID 67952228
4-Methyl-4-prop-1-enyloxane
CID 76623259
(E)-7-methoxy-6,6-dimethylhept-2-ene
CID 88232449
(E)-6-methoxy-5,5-dimethylhex-2-ene
CID 88232510

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-4-methylcyclopentene?
The IUPAC name of 4-(methoxymethyl)-4-methylcyclopentene (CID 59888767) is 4-(methoxymethyl)-4-methylcyclopentene.
What is the SMILES notation for 4-(methoxymethyl)-4-methylcyclopentene?
The canonical SMILES for 4-(methoxymethyl)-4-methylcyclopentene is COCC1(C)CC=CC1.
What is the InChIKey of 4-(methoxymethyl)-4-methylcyclopentene?
The InChIKey is YEVUTJQYBGLJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-8(7-9-2)5-3-4-6-8/h3-4H,5-7H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-4-methylcyclopentene?
4-(methoxymethyl)-4-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 4-(methoxymethyl)-4-methylcyclopentene is sourced from PubChem (CID 59888767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).