8-methylidenebicyclo[5.1.0]octane

C9H14 — CID 556475

IUPAC8-methylidenebicyclo[5.1.0]octane
SMILESC=C1C2CCCCCC12
InChIInChI=1S/C9H14/c1-7-8-5-3-2-4-6-9(7)8/h8-9H,1-6H2
InChIKeyMUDRFXBMCDULFP-UHFFFAOYSA-N
MW122.21 g/mol
LogP2.75
Rot. Bonds

About 8-methylidenebicyclo[5.1.0]octane

8-methylidenebicyclo[5.1.0]octane (PubChem CID 556475) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 8-methylidenebicyclo[5.1.0]octane.

Molecular Properties

Compound Name8-methylidenebicyclo[5.1.0]octane
PubChem CID556475
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name8-methylidenebicyclo[5.1.0]octane
SMILESC=C1C2CCCCCC12
InChIInChI=1S/C9H14/c1-7-8-5-3-2-4-6-9(7)8/h8-9H,1-6H2
InChIKeyMUDRFXBMCDULFP-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 8-methylidenebicyclo[5.1.0]octane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,7S)-8-methylidenebicyclo[5.1.0]octane
CID 16115824
(1S,8R)-9-methylidenebicyclo[6.1.0]nonane
CID 11768638
9-Methylidenebicyclo[6.1.0]nonane
CID 12695813
Methylidenebicyclo[6.1.0]nonane
CID 129815821
4-Methylidenebicyclo[6.1.0]nonane
CID 123181736
2,3,4,5-Tetramethyl-6-methylidenebicyclo[5.1.0]octane
CID 123221724
1-Methyl-3-methylidenebicyclo[5.1.0]octane
CID 123439793
1-Methyl-5-(2-methylidenecyclopropyl)cyclooctane
CID 123572040
2-(7,8-Dimethyl-6-methylidenenonyl)-5,8-dimethylbicyclo[5.1.0]octane
CID 123672686
5-Ethyl-1,6-dimethyl-8-methylidenebicyclo[5.1.0]octane
CID 124007999
(1S,5S)-2,6-dimethylidenebicyclo[3.3.2]decane
CID 11051974
2,6-Dimethylidenebicyclo[3.3.2]decane
CID 85381418

Frequently Asked Questions

What is the IUPAC name of 8-methylidenebicyclo[5.1.0]octane?
The IUPAC name of 8-methylidenebicyclo[5.1.0]octane (CID 556475) is 8-methylidenebicyclo[5.1.0]octane.
What is the SMILES notation for 8-methylidenebicyclo[5.1.0]octane?
The canonical SMILES for 8-methylidenebicyclo[5.1.0]octane is C=C1C2CCCCCC12.
What is the InChIKey of 8-methylidenebicyclo[5.1.0]octane?
The InChIKey is MUDRFXBMCDULFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-7-8-5-3-2-4-6-9(7)8/h8-9H,1-6H2.
What are the key properties of 8-methylidenebicyclo[5.1.0]octane?
8-methylidenebicyclo[5.1.0]octane has a molecular weight of 122.21 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylidenebicyclo[5.1.0]octane is sourced from PubChem (CID 556475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).