cubane;ethane

C10H14 — CID 163673038

IUPACcubane;ethane
SMILESC12C3C4C1C1C2C3C41.CC
InChIInChI=1S/C8H8.C2H6/c1-2-5-3(1)7-4(1)6(2)8(5)7;1-2/h1-8H;1-2H3
InChIKeyJEFRBBHJSHCYLB-UHFFFAOYSA-N
MW134.22 g/mol
LogP2.01
Rot. Bonds

About cubane;ethane

cubane;ethane (PubChem CID 163673038) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is cubane;ethane.

Molecular Properties

Compound Namecubane;ethane
PubChem CID163673038
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Namecubane;ethane
SMILESC12C3C4C1C1C2C3C41.CC
InChIInChI=1S/C8H8.C2H6/c1-2-5-3(1)7-4(1)6(2)8(5)7;1-2/h1-8H;1-2H3
InChIKeyJEFRBBHJSHCYLB-UHFFFAOYSA-N
XLogP2.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cubane;ethane?
The IUPAC name of cubane;ethane (CID 163673038) is cubane;ethane.
What is the SMILES notation for cubane;ethane?
The canonical SMILES for cubane;ethane is C12C3C4C1C1C2C3C41.CC.
What is the InChIKey of cubane;ethane?
The InChIKey is JEFRBBHJSHCYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.C2H6/c1-2-5-3(1)7-4(1)6(2)8(5)7;1-2/h1-8H;1-2H3.
What are the key properties of cubane;ethane?
cubane;ethane has a molecular weight of 134.22 g/mol, XLogP of 2.01, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cubane;ethane is sourced from PubChem (CID 163673038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).