2,2-dimethylpropylidenecyclopropane

C8H14 — CID 565326

IUPAC2,2-dimethylpropylidenecyclopropane
SMILESCC(C)(C)C=C1CC1
InChIInChI=1S/C8H14/c1-8(2,3)6-7-4-5-7/h6H,4-5H2,1-3H3
InChIKeyJLDHRUIYQYFHAN-UHFFFAOYSA-N
MW110.20 g/mol
LogP2.75
Rot. Bonds

About 2,2-dimethylpropylidenecyclopropane

2,2-dimethylpropylidenecyclopropane (PubChem CID 565326) has the molecular formula C8H14 and a molecular weight of 110.20 g/mol. Its IUPAC name is 2,2-dimethylpropylidenecyclopropane.

Molecular Properties

Compound Name2,2-dimethylpropylidenecyclopropane
PubChem CID565326
Molecular FormulaC8H14
Molecular Weight110.20 g/mol
Exact Mass110.11
IUPAC Name2,2-dimethylpropylidenecyclopropane
SMILESCC(C)(C)C=C1CC1
InChIInChI=1S/C8H14/c1-8(2,3)6-7-4-5-7/h6H,4-5H2,1-3H3
InChIKeyJLDHRUIYQYFHAN-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.20
LogP ≤ 52.75
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 2,2-dimethylpropylidenecyclopropane?
The IUPAC name of 2,2-dimethylpropylidenecyclopropane (CID 565326) is 2,2-dimethylpropylidenecyclopropane.
What is the SMILES notation for 2,2-dimethylpropylidenecyclopropane?
The canonical SMILES for 2,2-dimethylpropylidenecyclopropane is CC(C)(C)C=C1CC1.
What is the InChIKey of 2,2-dimethylpropylidenecyclopropane?
The InChIKey is JLDHRUIYQYFHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14/c1-8(2,3)6-7-4-5-7/h6H,4-5H2,1-3H3.
What are the key properties of 2,2-dimethylpropylidenecyclopropane?
2,2-dimethylpropylidenecyclopropane has a molecular weight of 110.20 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 2,2-dimethylpropylidenecyclopropane is sourced from PubChem (CID 565326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).