1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane

C9H14 — CID 90878254

IUPAC1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane
SMILESCC1C(C)C1C=C1CC1
InChIInChI=1S/C9H14/c1-6-7(2)9(6)5-8-3-4-8/h5-7,9H,3-4H2,1-2H3
InChIKeyFDTWZNDHPKCSDD-UHFFFAOYSA-N
MW122.21 g/mol
LogP2.61
Rot. Bonds1

About 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane

1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane (PubChem CID 90878254) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane.

Molecular Properties

Compound Name1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane
PubChem CID90878254
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane
SMILESCC1C(C)C1C=C1CC1
InChIInChI=1S/C9H14/c1-6-7(2)9(6)5-8-3-4-8/h5-7,9H,3-4H2,1-2H3
InChIKeyFDTWZNDHPKCSDD-UHFFFAOYSA-N
XLogP2.61
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 ≤ 52.61
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-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane?
The IUPAC name of 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane (CID 90878254) is 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane.
What is the SMILES notation for 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane?
The canonical SMILES for 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane is CC1C(C)C1C=C1CC1.
What is the InChIKey of 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane?
The InChIKey is FDTWZNDHPKCSDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-6-7(2)9(6)5-8-3-4-8/h5-7,9H,3-4H2,1-2H3.
What are the key properties of 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane?
1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane has a molecular weight of 122.21 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylidenemethyl)-2,3-dimethylcyclopropane is sourced from PubChem (CID 90878254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).