7-cyclopentylidenespiro[2.5]octane

C13H20 — CID 142060898

IUPAC7-cyclopentylidenespiro[2.5]octane
SMILESC1CCC(=C2CCCC3(CC3)C2)C1
InChIInChI=1S/C13H20/c1-2-5-11(4-1)12-6-3-7-13(10-12)8-9-13/h1-10H2
InChIKeyWUXRDHKEGAMSDU-UHFFFAOYSA-N
MW176.30 g/mol
LogP4.21
Rot. Bonds

About 7-cyclopentylidenespiro[2.5]octane

7-cyclopentylidenespiro[2.5]octane (PubChem CID 142060898) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is 7-cyclopentylidenespiro[2.5]octane.

Molecular Properties

Compound Name7-cyclopentylidenespiro[2.5]octane
PubChem CID142060898
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Name7-cyclopentylidenespiro[2.5]octane
SMILESC1CCC(=C2CCCC3(CC3)C2)C1
InChIInChI=1S/C13H20/c1-2-5-11(4-1)12-6-3-7-13(10-12)8-9-13/h1-10H2
InChIKeyWUXRDHKEGAMSDU-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 54.21
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-Methyl-6-(1-methylethylidene)bicyclo(3.1.0)hexane
CID 578236
1,3,3-Trimethyl-2-(2-methyl-cyclopropyl)-cyclohexene
CID 595941
8-Cyclopropylidenespiro[3.4]octane
CID 13662129
1-tert-Butyl-4-cyclopropylidenecyclohexane
CID 13280445
8-Cyclopropylidenedi-spiro[2.0.2.3]nonane
CID 101177781
3-Cyclopropylidene-1-methyl-1-prop-1-en-2-ylcyclohexane
CID 102109236
1,2,3,4,5,6-Hexamethylbicyclo[3.1.0]hex-2-ene
CID 291898
1-(Cyclopenten-1-yl)-1-cyclopropylcyclohexane
CID 57035265
7,8-Di(propan-2-yl)spiro[2.5]oct-7-ene
CID 58289811
(1S)-2-ethyl-6,6-dimethyl-4-propan-2-ylidenebicyclo[3.1.0]hexane
CID 58868643
1,2,3,4,4,5,6,6-Octamethylbicyclo[3.1.0]hex-2-ene
CID 58944292
(10E)-10-ethylidenespiro[4.5]decane
CID 59602255

Frequently Asked Questions

What is the IUPAC name of 7-cyclopentylidenespiro[2.5]octane?
The IUPAC name of 7-cyclopentylidenespiro[2.5]octane (CID 142060898) is 7-cyclopentylidenespiro[2.5]octane.
What is the SMILES notation for 7-cyclopentylidenespiro[2.5]octane?
The canonical SMILES for 7-cyclopentylidenespiro[2.5]octane is C1CCC(=C2CCCC3(CC3)C2)C1.
What is the InChIKey of 7-cyclopentylidenespiro[2.5]octane?
The InChIKey is WUXRDHKEGAMSDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20/c1-2-5-11(4-1)12-6-3-7-13(10-12)8-9-13/h1-10H2.
What are the key properties of 7-cyclopentylidenespiro[2.5]octane?
7-cyclopentylidenespiro[2.5]octane has a molecular weight of 176.30 g/mol, XLogP of 4.21, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopentylidenespiro[2.5]octane is sourced from PubChem (CID 142060898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).