3-methyl-4-methylidenecyclopentene

C7H10 — CID 59941732

IUPAC3-methyl-4-methylidenecyclopentene
SMILESC=C1CC=CC1C
InChIInChI=1S/C7H10/c1-6-4-3-5-7(6)2/h3,5,7H,1,4H2,2H3
InChIKeyQHRYMSDFEBRODE-UHFFFAOYSA-N
MW94.16 g/mol
LogP2.14
Rot. Bonds

About 3-methyl-4-methylidenecyclopentene

3-methyl-4-methylidenecyclopentene (PubChem CID 59941732) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is 3-methyl-4-methylidenecyclopentene.

Molecular Properties

Compound Name3-methyl-4-methylidenecyclopentene
PubChem CID59941732
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Name3-methyl-4-methylidenecyclopentene
SMILESC=C1CC=CC1C
InChIInChI=1S/C7H10/c1-6-4-3-5-7(6)2/h3,5,7H,1,4H2,2H3
InChIKeyQHRYMSDFEBRODE-UHFFFAOYSA-N
XLogP2.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 52.14
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

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CID 91444730
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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-methylidenecyclopentene?
The IUPAC name of 3-methyl-4-methylidenecyclopentene (CID 59941732) is 3-methyl-4-methylidenecyclopentene.
What is the SMILES notation for 3-methyl-4-methylidenecyclopentene?
The canonical SMILES for 3-methyl-4-methylidenecyclopentene is C=C1CC=CC1C.
What is the InChIKey of 3-methyl-4-methylidenecyclopentene?
The InChIKey is QHRYMSDFEBRODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10/c1-6-4-3-5-7(6)2/h3,5,7H,1,4H2,2H3.
What are the key properties of 3-methyl-4-methylidenecyclopentene?
3-methyl-4-methylidenecyclopentene has a molecular weight of 94.16 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-methylidenecyclopentene is sourced from PubChem (CID 59941732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).