methylidenecyclododecane

C13H24 — CID 2775264

IUPACmethylidenecyclododecane
SMILESC=C1CCCCCCCCCCC1
InChIInChI=1S/C13H24/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h1-12H2
InChIKeyFCUMNEBCUZTVQN-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.85
Rot. Bonds

About methylidenecyclododecane

methylidenecyclododecane (PubChem CID 2775264) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is methylidenecyclododecane.

Molecular Properties

Compound Namemethylidenecyclododecane
PubChem CID2775264
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Namemethylidenecyclododecane
SMILESC=C1CCCCCCCCCCC1
InChIInChI=1S/C13H24/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h1-12H2
InChIKeyFCUMNEBCUZTVQN-UHFFFAOYSA-N
XLogP4.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methylidenecyclododecane?
The IUPAC name of methylidenecyclododecane (CID 2775264) is methylidenecyclododecane.
What is the SMILES notation for methylidenecyclododecane?
The canonical SMILES for methylidenecyclododecane is C=C1CCCCCCCCCCC1.
What is the InChIKey of methylidenecyclododecane?
The InChIKey is FCUMNEBCUZTVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h1-12H2.
What are the key properties of methylidenecyclododecane?
methylidenecyclododecane has a molecular weight of 180.33 g/mol, XLogP of 4.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylidenecyclododecane is sourced from PubChem (CID 2775264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).