1-methyl-2-(2-methylcyclopropylidene)cyclopropane

C8H12 — CID 54058828

IUPAC1-methyl-2-(2-methylcyclopropylidene)cyclopropane
SMILESCC1CC1=C1CC1C
InChIInChI=1S/C8H12/c1-5-3-7(5)8-4-6(8)2/h5-6H,3-4H2,1-2H3
InChIKeyLYEQKGRNKTUMRH-UHFFFAOYSA-N
MW108.18 g/mol
LogP2.36
Rot. Bonds

About 1-methyl-2-(2-methylcyclopropylidene)cyclopropane

1-methyl-2-(2-methylcyclopropylidene)cyclopropane (PubChem CID 54058828) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is 1-methyl-2-(2-methylcyclopropylidene)cyclopropane.

Molecular Properties

Compound Name1-methyl-2-(2-methylcyclopropylidene)cyclopropane
PubChem CID54058828
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name1-methyl-2-(2-methylcyclopropylidene)cyclopropane
SMILESCC1CC1=C1CC1C
InChIInChI=1S/C8H12/c1-5-3-7(5)8-4-6(8)2/h5-6H,3-4H2,1-2H3
InChIKeyLYEQKGRNKTUMRH-UHFFFAOYSA-N
XLogP2.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.36
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 1-methyl-2-(2-methylcyclopropylidene)cyclopropane?
The IUPAC name of 1-methyl-2-(2-methylcyclopropylidene)cyclopropane (CID 54058828) is 1-methyl-2-(2-methylcyclopropylidene)cyclopropane.
What is the SMILES notation for 1-methyl-2-(2-methylcyclopropylidene)cyclopropane?
The canonical SMILES for 1-methyl-2-(2-methylcyclopropylidene)cyclopropane is CC1CC1=C1CC1C.
What is the InChIKey of 1-methyl-2-(2-methylcyclopropylidene)cyclopropane?
The InChIKey is LYEQKGRNKTUMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12/c1-5-3-7(5)8-4-6(8)2/h5-6H,3-4H2,1-2H3.
What are the key properties of 1-methyl-2-(2-methylcyclopropylidene)cyclopropane?
1-methyl-2-(2-methylcyclopropylidene)cyclopropane has a molecular weight of 108.18 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(2-methylcyclopropylidene)cyclopropane is sourced from PubChem (CID 54058828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).