1,2-dimethyl-3-methylidenecyclopropane

C6H10 — CID 548847

IUPAC1,2-dimethyl-3-methylidenecyclopropane
SMILESC=C1C(C)C1C
InChIInChI=1S/C6H10/c1-4-5(2)6(4)3/h5-6H,1H2,2-3H3
InChIKeyGCCQULABFXEDCE-UHFFFAOYSA-N
MW82.15 g/mol
LogP1.83
Rot. Bonds

About 1,2-dimethyl-3-methylidenecyclopropane

1,2-dimethyl-3-methylidenecyclopropane (PubChem CID 548847) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol. Its IUPAC name is 1,2-dimethyl-3-methylidenecyclopropane.

Molecular Properties

Compound Name1,2-dimethyl-3-methylidenecyclopropane
PubChem CID548847
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name1,2-dimethyl-3-methylidenecyclopropane
SMILESC=C1C(C)C1C
InChIInChI=1S/C6H10/c1-4-5(2)6(4)3/h5-6H,1H2,2-3H3
InChIKeyGCCQULABFXEDCE-UHFFFAOYSA-N
XLogP1.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.15
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2-dimethyl-3-methylidenecyclopropane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-methylidenecyclopropane?
The IUPAC name of 1,2-dimethyl-3-methylidenecyclopropane (CID 548847) is 1,2-dimethyl-3-methylidenecyclopropane.
What is the SMILES notation for 1,2-dimethyl-3-methylidenecyclopropane?
The canonical SMILES for 1,2-dimethyl-3-methylidenecyclopropane is C=C1C(C)C1C.
What is the InChIKey of 1,2-dimethyl-3-methylidenecyclopropane?
The InChIKey is GCCQULABFXEDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10/c1-4-5(2)6(4)3/h5-6H,1H2,2-3H3.
What are the key properties of 1,2-dimethyl-3-methylidenecyclopropane?
1,2-dimethyl-3-methylidenecyclopropane has a molecular weight of 82.15 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-methylidenecyclopropane is sourced from PubChem (CID 548847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).