2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane

C8H12 — CID 123620101

IUPAC2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane
SMILESC=CC1C(=C)C1(C)C
InChIInChI=1S/C8H12/c1-5-7-6(2)8(7,3)4/h5,7H,1-2H2,3-4H3
InChIKeyFCMCXNFAWIXMTA-UHFFFAOYSA-N
MW108.18 g/mol
LogP2.38
Rot. Bonds1

About 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane

2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane (PubChem CID 123620101) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane.

Molecular Properties

Compound Name2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane
PubChem CID123620101
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane
SMILESC=CC1C(=C)C1(C)C
InChIInChI=1S/C8H12/c1-5-7-6(2)8(7,3)4/h5,7H,1-2H2,3-4H3
InChIKeyFCMCXNFAWIXMTA-UHFFFAOYSA-N
XLogP2.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1-Dimethyl-2-(2-methyl-1-propenyl)cyclopropane
CID 520632
1,1,2,2-Tetramethyl-3-methylenecyclopropane
CID 143158
2-Ethenyl-1,1-dimethylcyclopropane
CID 12496218
Cyclopropane, 1,1-dimethyl-2-(1-methyl-2-propenyl)-
CID 534898
Cyclopropane, 1,1-dimethyl-2-(2-propenyl)-
CID 534921
3-Methyl-3-cyclopropylpropene
CID 12663409
3-Methyl-3-cyclopropylcyclopropene
CID 12512305
1,1-Dimethyl-2-isopropenylcyclopropane
CID 12950127
1,1-Diethyl-2-vinylcyclopropane
CID 57196111
2-[(E)-2-fluoroethenyl]-1,1-dimethylcyclopropane
CID 23167456
2-(2-Fluoroethenyl)-1,1-dimethylcyclopropane
CID 54535276
1,1,2-Trimethyl-3-methylenecyclopropane
CID 556843

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane?
The IUPAC name of 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane (CID 123620101) is 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane.
What is the SMILES notation for 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane?
The canonical SMILES for 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane is C=CC1C(=C)C1(C)C.
What is the InChIKey of 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane?
The InChIKey is FCMCXNFAWIXMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12/c1-5-7-6(2)8(7,3)4/h5,7H,1-2H2,3-4H3.
What are the key properties of 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane?
2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane has a molecular weight of 108.18 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,1-dimethyl-3-methylidenecyclopropane is sourced from PubChem (CID 123620101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).