dispiro[2.2.46.23]dodecane

C12H20 — CID 123747481

IUPACdispiro[2.2.46.23]dodecane
SMILESC1CCC2(C1)CCC1(CC2)CC1
InChIInChI=1S/C12H20/c1-2-4-11(3-1)5-7-12(8-6-11)9-10-12/h1-10H2
InChIKeyWVZVZUBVJBYPTK-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.90
Rot. Bonds

About dispiro[2.2.46.23]dodecane

dispiro[2.2.46.23]dodecane (PubChem CID 123747481) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is dispiro[2.2.46.23]dodecane.

Molecular Properties

Compound Namedispiro[2.2.46.23]dodecane
PubChem CID123747481
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Namedispiro[2.2.46.23]dodecane
SMILESC1CCC2(C1)CCC1(CC2)CC1
InChIInChI=1S/C12H20/c1-2-4-11(3-1)5-7-12(8-6-11)9-10-12/h1-10H2
InChIKeyWVZVZUBVJBYPTK-UHFFFAOYSA-N
XLogP3.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dispiro[2.2.46.23]dodecane?
The IUPAC name of dispiro[2.2.46.23]dodecane (CID 123747481) is dispiro[2.2.46.23]dodecane.
What is the SMILES notation for dispiro[2.2.46.23]dodecane?
The canonical SMILES for dispiro[2.2.46.23]dodecane is C1CCC2(C1)CCC1(CC2)CC1.
What is the InChIKey of dispiro[2.2.46.23]dodecane?
The InChIKey is WVZVZUBVJBYPTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-2-4-11(3-1)5-7-12(8-6-11)9-10-12/h1-10H2.
What are the key properties of dispiro[2.2.46.23]dodecane?
dispiro[2.2.46.23]dodecane has a molecular weight of 164.29 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dispiro[2.2.46.23]dodecane is sourced from PubChem (CID 123747481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).