About 1-(cyclopropylidenemethyl)-1-methylcyclopropane
1-(cyclopropylidenemethyl)-1-methylcyclopropane (PubChem CID 11658287) has the molecular formula C8H12
and a molecular weight of 108.18 g/mol. Its IUPAC name is 1-(cyclopropylidenemethyl)-1-methylcyclopropane.
Molecular Properties
| Compound Name | 1-(cyclopropylidenemethyl)-1-methylcyclopropane |
| PubChem CID | 11658287 |
| Molecular Formula | C8H12 |
| Molecular Weight | 108.18 g/mol |
| Exact Mass | 108.09 |
| IUPAC Name | 1-(cyclopropylidenemethyl)-1-methylcyclopropane |
| SMILES | CC1(C=C2CC2)CC1 |
| InChI | InChI=1S/C8H12/c1-8(4-5-8)6-7-2-3-7/h6H,2-5H2,1H3 |
| InChIKey | HVHDCMNMTBZADP-UHFFFAOYSA-N |
| XLogP | 2.51 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 108.18 |
| LogP ≤ 5 | 2.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 1-(cyclopropylidenemethyl)-1-methylcyclopropane?
The IUPAC name of 1-(cyclopropylidenemethyl)-1-methylcyclopropane (CID 11658287) is 1-(cyclopropylidenemethyl)-1-methylcyclopropane.
What is the SMILES notation for 1-(cyclopropylidenemethyl)-1-methylcyclopropane?
The canonical SMILES for 1-(cyclopropylidenemethyl)-1-methylcyclopropane is CC1(C=C2CC2)CC1.
What is the InChIKey of 1-(cyclopropylidenemethyl)-1-methylcyclopropane?
The InChIKey is HVHDCMNMTBZADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12/c1-8(4-5-8)6-7-2-3-7/h6H,2-5H2,1H3.
What are the key properties of 1-(cyclopropylidenemethyl)-1-methylcyclopropane?
1-(cyclopropylidenemethyl)-1-methylcyclopropane has a molecular weight of 108.18 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylidenemethyl)-1-methylcyclopropane is sourced from PubChem (CID 11658287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).