2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane

C16H20 — CID 91437730

IUPAC2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane
SMILESC=C1CC2CC1CC2=C1CC2CC1CC2=C
InChIInChI=1S/C16H20/c1-9-3-13-5-11(9)7-15(13)16-8-12-6-14(16)4-10(12)2/h11-14H,1-8H2
InChIKeyGMRPKTCAUATQJP-UHFFFAOYSA-N
MW212.34 g/mol
LogP4.26
Rot. Bonds

About 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane

2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane (PubChem CID 91437730) has the molecular formula C16H20 and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane
PubChem CID91437730
Molecular FormulaC16H20
Molecular Weight212.34 g/mol
Exact Mass212.16
IUPAC Name2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane
SMILESC=C1CC2CC1CC2=C1CC2CC1CC2=C
InChIInChI=1S/C16H20/c1-9-3-13-5-11(9)7-15(13)16-8-12-6-14(16)4-10(12)2/h11-14H,1-8H2
InChIKeyGMRPKTCAUATQJP-UHFFFAOYSA-N
XLogP4.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane with MolForge

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Related Compounds

4,5-dimethyltricyclo[6.2.1.02,7]undec-2(7)-ene
CID 141412995
(1S,4S)-2,3-dimethylidenebicyclo[2.2.1]heptane
CID 50919081
(1S,5R)-6-methylidene-2-oxabicyclo[3.3.1]nonan-3-one
CID 131857123
(1R,4R,9S,12S)-tetracyclo[10.2.1.02,11.04,9]pentadeca-2(11),6-diene-5,8-dione
CID 13484355
1-isocyanato-2-methylidenecyclopropane
CID 105426924
(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene
CID 13425243
4-tricyclo[6.2.1.02,7]undec-2(7)-enylmethanol
CID 130126509
7-methylidenebicyclo[3.2.1]octane-3,6-dione
CID 176564530
(1R)-2-methylidenecyclopropane-1-carboxylic acid
CID 54231794
tricyclo[4.4.1.02,4]undec-2(4)-ene
CID 123898174
bicyclo[1.1.1]pentan-2-one
CID 13356641
9-ethylidene-4-methyltricyclo[6.2.1.02,7]undec-2(7)-ene
CID 54244186

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane?
The IUPAC name of 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane (CID 91437730) is 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane.
What is the SMILES notation for 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane?
The canonical SMILES for 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane is C=C1CC2CC1CC2=C1CC2CC1CC2=C.
What is the InChIKey of 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane?
The InChIKey is GMRPKTCAUATQJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20/c1-9-3-13-5-11(9)7-15(13)16-8-12-6-14(16)4-10(12)2/h11-14H,1-8H2.
What are the key properties of 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane?
2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane has a molecular weight of 212.34 g/mol, XLogP of 4.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-5-(5-methylidene-2-bicyclo[2.2.1]heptanylidene)bicyclo[2.2.1]heptane is sourced from PubChem (CID 91437730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).