1-(2-cyclopropylethenyl)-1-methylcyclopropane

C9H14 — CID 85439382

IUPAC1-(2-cyclopropylethenyl)-1-methylcyclopropane
SMILESCC1(C=CC2CC2)CC1
InChIInChI=1S/C9H14/c1-9(6-7-9)5-4-8-2-3-8/h4-5,8H,2-3,6-7H2,1H3
InChIKeyQBPNYEVXCLSGQH-UHFFFAOYSA-N
MW122.21 g/mol
LogP2.75
Rot. Bonds2

About 1-(2-cyclopropylethenyl)-1-methylcyclopropane

1-(2-cyclopropylethenyl)-1-methylcyclopropane (PubChem CID 85439382) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-(2-cyclopropylethenyl)-1-methylcyclopropane.

Molecular Properties

Compound Name1-(2-cyclopropylethenyl)-1-methylcyclopropane
PubChem CID85439382
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-(2-cyclopropylethenyl)-1-methylcyclopropane
SMILESCC1(C=CC2CC2)CC1
InChIInChI=1S/C9H14/c1-9(6-7-9)5-4-8-2-3-8/h4-5,8H,2-3,6-7H2,1H3
InChIKeyQBPNYEVXCLSGQH-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
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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Related Compounds

Dispiro[2.2.2.2]deca-4,9-diene
CID 142064
Cyclopropane, 1,1'-(1,2-ethenediyl)bis-, (E)-
CID 5462736
Cyclopropane, 1,1'-(1,2-ethenediyl)bis-, (Z)-
CID 5463042
(Cyclopropylidenemethyl)-1-methylcyclopropane
CID 11658287
Dicyclopropyl ethylene
CID 139135
1-Cyclopropyl-2-pentene
CID 91286227
[(Z)-3-methylbut-1-enyl]cyclopropane
CID 101599262
Divinylbicyclopropylidene
CID 129653518
cis-Dipropenyl cyclopropane
CID 129864593
trans-(1R,2R)-1-ethenyl-2-[(E)-prop-1-enyl]cyclopropane
CID 134886673
trans-(1R,2R)-1,2-bis[(E)-prop-1-enyl]cyclopropane
CID 134886716
trans-(1S,2S)-2-[(Z)-prop-1-enyl]-1-[(E)-prop-1-enyl]cyclopropane
CID 134887021

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylethenyl)-1-methylcyclopropane?
The IUPAC name of 1-(2-cyclopropylethenyl)-1-methylcyclopropane (CID 85439382) is 1-(2-cyclopropylethenyl)-1-methylcyclopropane.
What is the SMILES notation for 1-(2-cyclopropylethenyl)-1-methylcyclopropane?
The canonical SMILES for 1-(2-cyclopropylethenyl)-1-methylcyclopropane is CC1(C=CC2CC2)CC1.
What is the InChIKey of 1-(2-cyclopropylethenyl)-1-methylcyclopropane?
The InChIKey is QBPNYEVXCLSGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-9(6-7-9)5-4-8-2-3-8/h4-5,8H,2-3,6-7H2,1H3.
What are the key properties of 1-(2-cyclopropylethenyl)-1-methylcyclopropane?
1-(2-cyclopropylethenyl)-1-methylcyclopropane has a molecular weight of 122.21 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylethenyl)-1-methylcyclopropane is sourced from PubChem (CID 85439382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).