tetracyclo[6.4.0.02,4.05,7]dodecane

C12H18 — CID 18359650

IUPACtetracyclo[6.4.0.02,4.05,7]dodecane
SMILESC1CCC2C(C1)C1CC1C1CC21
InChIInChI=1S/C12H18/c1-2-4-8-7(3-1)9-5-11(9)12-6-10(8)12/h7-12H,1-6H2
InChIKeyHLWQTFRIRUTOIX-UHFFFAOYSA-N
MW162.28 g/mol
LogP3.08
Rot. Bonds

About tetracyclo[6.4.0.02,4.05,7]dodecane

tetracyclo[6.4.0.02,4.05,7]dodecane (PubChem CID 18359650) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is tetracyclo[6.4.0.02,4.05,7]dodecane.

Molecular Properties

Compound Nametetracyclo[6.4.0.02,4.05,7]dodecane
PubChem CID18359650
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Nametetracyclo[6.4.0.02,4.05,7]dodecane
SMILESC1CCC2C(C1)C1CC1C1CC21
InChIInChI=1S/C12H18/c1-2-4-8-7(3-1)9-5-11(9)12-6-10(8)12/h7-12H,1-6H2
InChIKeyHLWQTFRIRUTOIX-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tetracyclo[6.4.0.02,4.05,7]dodecane?
The IUPAC name of tetracyclo[6.4.0.02,4.05,7]dodecane (CID 18359650) is tetracyclo[6.4.0.02,4.05,7]dodecane.
What is the SMILES notation for tetracyclo[6.4.0.02,4.05,7]dodecane?
The canonical SMILES for tetracyclo[6.4.0.02,4.05,7]dodecane is C1CCC2C(C1)C1CC1C1CC21.
What is the InChIKey of tetracyclo[6.4.0.02,4.05,7]dodecane?
The InChIKey is HLWQTFRIRUTOIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-2-4-8-7(3-1)9-5-11(9)12-6-10(8)12/h7-12H,1-6H2.
What are the key properties of tetracyclo[6.4.0.02,4.05,7]dodecane?
tetracyclo[6.4.0.02,4.05,7]dodecane has a molecular weight of 162.28 g/mol, XLogP of 3.08, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[6.4.0.02,4.05,7]dodecane is sourced from PubChem (CID 18359650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).