(2Z)-2-but-3-enylidenespiro[2.2]pentane

C9H12 — CID 11105352

IUPAC(2Z)-2-but-3-enylidenespiro[2.2]pentane
SMILESC=CC/C=C1/CC12CC2
InChIInChI=1S/C9H12/c1-2-3-4-8-7-9(8)5-6-9/h2,4H,1,3,5-7H2/b8-4-
InChIKeyJNVBSEZHPSFFKG-YWEYNIOJSA-N
MW120.19 g/mol
LogP2.67
Rot. Bonds2

About (2Z)-2-but-3-enylidenespiro[2.2]pentane

(2Z)-2-but-3-enylidenespiro[2.2]pentane (PubChem CID 11105352) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is (2Z)-2-but-3-enylidenespiro[2.2]pentane.

Molecular Properties

Compound Name(2Z)-2-but-3-enylidenespiro[2.2]pentane
PubChem CID11105352
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name(2Z)-2-but-3-enylidenespiro[2.2]pentane
SMILESC=CC/C=C1/CC12CC2
InChIInChI=1S/C9H12/c1-2-3-4-8-7-9(8)5-6-9/h2,4H,1,3,5-7H2/b8-4-
InChIKeyJNVBSEZHPSFFKG-YWEYNIOJSA-N
XLogP2.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.67
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
(Cyclopropylidenemethyl)-1-methylcyclopropane
CID 11658287
2-Cyclopropylidenespiro[2.2]pentane
CID 11804693
1,1'-(Butane-1,4-diylidene)dicyclopropane
CID 12480864
Divinylbicyclopropylidene
CID 129653518
(2Z)-2-spiro[2.2]pentan-2-ylidenespiro[2.2]pentane
CID 134993937
1-[(E)-3-cyclopropylideneprop-1-enyl]-1-prop-2-enylcyclopropane
CID 101177777
1-Cyclopropylidene-2-ethenylcyclopropane
CID 10975429
Hex-5-enylidenecyclopropane
CID 22637337
1-(2-Cyclopropylethenyl)-1-methylcyclopropane
CID 85439382
1-(2-Cyclopropylideneethyl)-2-methylidenecyclopropane
CID 91251406
1-(Cyclopropylidenemethyl)-2-methylcyclopropane
CID 123343927

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-but-3-enylidenespiro[2.2]pentane?
The IUPAC name of (2Z)-2-but-3-enylidenespiro[2.2]pentane (CID 11105352) is (2Z)-2-but-3-enylidenespiro[2.2]pentane.
What is the SMILES notation for (2Z)-2-but-3-enylidenespiro[2.2]pentane?
The canonical SMILES for (2Z)-2-but-3-enylidenespiro[2.2]pentane is C=CC/C=C1/CC12CC2.
What is the InChIKey of (2Z)-2-but-3-enylidenespiro[2.2]pentane?
The InChIKey is JNVBSEZHPSFFKG-YWEYNIOJSA-N. The full InChI is InChI=1S/C9H12/c1-2-3-4-8-7-9(8)5-6-9/h2,4H,1,3,5-7H2/b8-4-.
What are the key properties of (2Z)-2-but-3-enylidenespiro[2.2]pentane?
(2Z)-2-but-3-enylidenespiro[2.2]pentane has a molecular weight of 120.19 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-but-3-enylidenespiro[2.2]pentane is sourced from PubChem (CID 11105352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).