6-ethenyl-7-methylbicyclo[3.2.0]heptane

C10H16 — CID 147666002

IUPAC6-ethenyl-7-methylbicyclo[3.2.0]heptane
SMILESC=CC1C(C)C2CCCC12
InChIInChI=1S/C10H16/c1-3-8-7(2)9-5-4-6-10(8)9/h3,7-10H,1,4-6H2,2H3
InChIKeyGMHSQMCDNVGQIG-UHFFFAOYSA-N
MW136.24 g/mol
LogP2.85
Rot. Bonds1

About 6-ethenyl-7-methylbicyclo[3.2.0]heptane

6-ethenyl-7-methylbicyclo[3.2.0]heptane (PubChem CID 147666002) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 6-ethenyl-7-methylbicyclo[3.2.0]heptane.

Molecular Properties

Compound Name6-ethenyl-7-methylbicyclo[3.2.0]heptane
PubChem CID147666002
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name6-ethenyl-7-methylbicyclo[3.2.0]heptane
SMILESC=CC1C(C)C2CCCC12
InChIInChI=1S/C10H16/c1-3-8-7(2)9-5-4-6-10(8)9/h3,7-10H,1,4-6H2,2H3
InChIKeyGMHSQMCDNVGQIG-UHFFFAOYSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.85
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 6-ethenyl-7-methylbicyclo[3.2.0]heptane?
The IUPAC name of 6-ethenyl-7-methylbicyclo[3.2.0]heptane (CID 147666002) is 6-ethenyl-7-methylbicyclo[3.2.0]heptane.
What is the SMILES notation for 6-ethenyl-7-methylbicyclo[3.2.0]heptane?
The canonical SMILES for 6-ethenyl-7-methylbicyclo[3.2.0]heptane is C=CC1C(C)C2CCCC12.
What is the InChIKey of 6-ethenyl-7-methylbicyclo[3.2.0]heptane?
The InChIKey is GMHSQMCDNVGQIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-3-8-7(2)9-5-4-6-10(8)9/h3,7-10H,1,4-6H2,2H3.
What are the key properties of 6-ethenyl-7-methylbicyclo[3.2.0]heptane?
6-ethenyl-7-methylbicyclo[3.2.0]heptane has a molecular weight of 136.24 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-7-methylbicyclo[3.2.0]heptane is sourced from PubChem (CID 147666002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).