11-methyltetracyclo[8.2.0.02,4.06,8]dodecane

C13H20 — CID 123240466

IUPAC11-methyltetracyclo[8.2.0.02,4.06,8]dodecane
SMILESCC1CC2C1CC1CC1CC1CC12
InChIInChI=1S/C13H20/c1-7-2-13-11(7)5-9-3-8(9)4-10-6-12(10)13/h7-13H,2-6H2,1H3
InChIKeyJEZGXEYAGGDXBB-UHFFFAOYSA-N
MW176.30 g/mol
LogP3.32
Rot. Bonds

About 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane

11-methyltetracyclo[8.2.0.02,4.06,8]dodecane (PubChem CID 123240466) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane.

Molecular Properties

Compound Name11-methyltetracyclo[8.2.0.02,4.06,8]dodecane
PubChem CID123240466
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Name11-methyltetracyclo[8.2.0.02,4.06,8]dodecane
SMILESCC1CC2C1CC1CC1CC1CC12
InChIInChI=1S/C13H20/c1-7-2-13-11(7)5-9-3-8(9)4-10-6-12(10)13/h7-13H,2-6H2,1H3
InChIKeyJEZGXEYAGGDXBB-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane?
The IUPAC name of 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane (CID 123240466) is 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane.
What is the SMILES notation for 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane?
The canonical SMILES for 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane is CC1CC2C1CC1CC1CC1CC12.
What is the InChIKey of 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane?
The InChIKey is JEZGXEYAGGDXBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20/c1-7-2-13-11(7)5-9-3-8(9)4-10-6-12(10)13/h7-13H,2-6H2,1H3.
What are the key properties of 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane?
11-methyltetracyclo[8.2.0.02,4.06,8]dodecane has a molecular weight of 176.30 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyltetracyclo[8.2.0.02,4.06,8]dodecane is sourced from PubChem (CID 123240466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).