3-methylcyclopentene

C6H10 — CID 14263

IUPAC3-methylcyclopentene
SMILESCC1C=CCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3
InChIKeyCXOZQHPXKPDQGT-UHFFFAOYSA-N
MW82.15 g/mol
LogP1.97
Rot. Bonds

About 3-methylcyclopentene

3-methylcyclopentene (PubChem CID 14263) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol. Its IUPAC name is 3-methylcyclopentene.

Molecular Properties

Compound Name3-methylcyclopentene
PubChem CID14263
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name3-methylcyclopentene
SMILESCC1C=CCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3
InChIKeyCXOZQHPXKPDQGT-UHFFFAOYSA-N
XLogP1.97
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 ≤ 51.97
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

Dihydromyrcene
CID 17090
Dihydromyrcene, (+)-
CID 10887985
Norbornadiene
CID 8473
5-Methyl-1-hexene
CID 77058
4-Methylcyclohexene
CID 11572
3-Methylcyclohexene
CID 11573
3-Methyl-1-hexene
CID 18848
Dihydromyrcene, (-)-
CID 10997105
2-Isopropyl-1,4-hexadiene
CID 6429324
3-Propyl-1-cyclopentene
CID 36671
3-Ethylcyclopentene
CID 79095
4-Methyl-2-hexene
CID 5357249

Frequently Asked Questions

What is the IUPAC name of 3-methylcyclopentene?
The IUPAC name of 3-methylcyclopentene (CID 14263) is 3-methylcyclopentene.
What is the SMILES notation for 3-methylcyclopentene?
The canonical SMILES for 3-methylcyclopentene is CC1C=CCC1.
What is the InChIKey of 3-methylcyclopentene?
The InChIKey is CXOZQHPXKPDQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3.
What are the key properties of 3-methylcyclopentene?
3-methylcyclopentene has a molecular weight of 82.15 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylcyclopentene is sourced from PubChem (CID 14263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).