1-methylcyclopentene

C6H10 — CID 12746

IUPAC1-methylcyclopentene
SMILESCC1=CCCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h4H,2-3,5H2,1H3
InChIKeyATQUFXWBVZUTKO-UHFFFAOYSA-N
MW82.15 g/mol
LogP2.12
Rot. Bonds

About 1-methylcyclopentene

1-methylcyclopentene (PubChem CID 12746) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol. Its IUPAC name is 1-methylcyclopentene.

Molecular Properties

Compound Name1-methylcyclopentene
PubChem CID12746
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name1-methylcyclopentene
SMILESCC1=CCCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h4H,2-3,5H2,1H3
InChIKeyATQUFXWBVZUTKO-UHFFFAOYSA-N
XLogP2.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.15
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-Methylcyclohexene
CID 11574
3-Ethyl-2-pentene
CID 13159
Geraniolene
CID 81203
4-Propyl-3-heptene
CID 138270
Ethylidenecyclohexane
CID 13856
2,6,10-Trimethyldodeca-2,6,10-triene
CID 4475483
2-Methyl-2-hexene
CID 17656
2-Methyl-2-heptene
CID 12330
(6E,10E)-2,6,10-trimethyldodeca-2,6,10-triene
CID 444108
(6E)-2,6-dimethyl-2,6-octadiene
CID 5365898
3-Methyl-2-cyclopentene-1-thione
CID 14252428
1-Propylcyclopentene
CID 137815

Frequently Asked Questions

What is the IUPAC name of 1-methylcyclopentene?
The IUPAC name of 1-methylcyclopentene (CID 12746) is 1-methylcyclopentene.
What is the SMILES notation for 1-methylcyclopentene?
The canonical SMILES for 1-methylcyclopentene is CC1=CCCC1.
What is the InChIKey of 1-methylcyclopentene?
The InChIKey is ATQUFXWBVZUTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10/c1-6-4-2-3-5-6/h4H,2-3,5H2,1H3.
What are the key properties of 1-methylcyclopentene?
1-methylcyclopentene has a molecular weight of 82.15 g/mol, XLogP of 2.12, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylcyclopentene is sourced from PubChem (CID 12746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).