1-(1-cyclopropylideneethyl)-1-methylcyclopropane

C9H14 — CID 12567930

IUPAC1-(1-cyclopropylideneethyl)-1-methylcyclopropane
SMILESCC(=C1CC1)C1(C)CC1
InChIInChI=1S/C9H14/c1-7(8-3-4-8)9(2)5-6-9/h3-6H2,1-2H3
InChIKeyBXIDZTSZMVRCHX-UHFFFAOYSA-N
MW122.21 g/mol
LogP2.90
Rot. Bonds1

About 1-(1-cyclopropylideneethyl)-1-methylcyclopropane

1-(1-cyclopropylideneethyl)-1-methylcyclopropane (PubChem CID 12567930) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-(1-cyclopropylideneethyl)-1-methylcyclopropane.

Molecular Properties

Compound Name1-(1-cyclopropylideneethyl)-1-methylcyclopropane
PubChem CID12567930
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-(1-cyclopropylideneethyl)-1-methylcyclopropane
SMILESCC(=C1CC1)C1(C)CC1
InChIInChI=1S/C9H14/c1-7(8-3-4-8)9(2)5-6-9/h3-6H2,1-2H3
InChIKeyBXIDZTSZMVRCHX-UHFFFAOYSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 52.90
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-(1-cyclopropylideneethyl)-1-methylcyclopropane?
The IUPAC name of 1-(1-cyclopropylideneethyl)-1-methylcyclopropane (CID 12567930) is 1-(1-cyclopropylideneethyl)-1-methylcyclopropane.
What is the SMILES notation for 1-(1-cyclopropylideneethyl)-1-methylcyclopropane?
The canonical SMILES for 1-(1-cyclopropylideneethyl)-1-methylcyclopropane is CC(=C1CC1)C1(C)CC1.
What is the InChIKey of 1-(1-cyclopropylideneethyl)-1-methylcyclopropane?
The InChIKey is BXIDZTSZMVRCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-7(8-3-4-8)9(2)5-6-9/h3-6H2,1-2H3.
What are the key properties of 1-(1-cyclopropylideneethyl)-1-methylcyclopropane?
1-(1-cyclopropylideneethyl)-1-methylcyclopropane has a molecular weight of 122.21 g/mol, XLogP of 2.90, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylideneethyl)-1-methylcyclopropane is sourced from PubChem (CID 12567930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).