2-methyl-5-methylidenespiro[2.2]pent-1-ene

C7H8 — CID 123925400

IUPAC2-methyl-5-methylidenespiro[2.2]pent-1-ene
SMILESC=C1CC12C=C2C
InChIInChI=1S/C7H8/c1-5-3-7(5)4-6(7)2/h4H,1,3H2,2H3
InChIKeyULSTVNMUEWBMIQ-UHFFFAOYSA-N
MW92.14 g/mol
LogP1.89
Rot. Bonds

About 2-methyl-5-methylidenespiro[2.2]pent-1-ene

2-methyl-5-methylidenespiro[2.2]pent-1-ene (PubChem CID 123925400) has the molecular formula C7H8 and a molecular weight of 92.14 g/mol. Its IUPAC name is 2-methyl-5-methylidenespiro[2.2]pent-1-ene.

Molecular Properties

Compound Name2-methyl-5-methylidenespiro[2.2]pent-1-ene
PubChem CID123925400
Molecular FormulaC7H8
Molecular Weight92.14 g/mol
Exact Mass92.06
IUPAC Name2-methyl-5-methylidenespiro[2.2]pent-1-ene
SMILESC=C1CC12C=C2C
InChIInChI=1S/C7H8/c1-5-3-7(5)4-6(7)2/h4H,1,3H2,2H3
InChIKeyULSTVNMUEWBMIQ-UHFFFAOYSA-N
XLogP1.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.14
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2-methyl-5-methylidenespiro[2.2]pent-1-ene?
The IUPAC name of 2-methyl-5-methylidenespiro[2.2]pent-1-ene (CID 123925400) is 2-methyl-5-methylidenespiro[2.2]pent-1-ene.
What is the SMILES notation for 2-methyl-5-methylidenespiro[2.2]pent-1-ene?
The canonical SMILES for 2-methyl-5-methylidenespiro[2.2]pent-1-ene is C=C1CC12C=C2C.
What is the InChIKey of 2-methyl-5-methylidenespiro[2.2]pent-1-ene?
The InChIKey is ULSTVNMUEWBMIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8/c1-5-3-7(5)4-6(7)2/h4H,1,3H2,2H3.
What are the key properties of 2-methyl-5-methylidenespiro[2.2]pent-1-ene?
2-methyl-5-methylidenespiro[2.2]pent-1-ene has a molecular weight of 92.14 g/mol, XLogP of 1.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-methylidenespiro[2.2]pent-1-ene is sourced from PubChem (CID 123925400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).