cyclooctane;methylcyclobutane

C13H26 — CID 159456217

IUPACcyclooctane;methylcyclobutane
SMILESC1CCCCCCC1.CC1CCC1
InChIInChI=1S/C8H16.C5H10/c1-2-4-6-8-7-5-3-1;1-5-3-2-4-5/h1-8H2;5H,2-4H2,1H3
InChIKeyLTZTXDHJZOBKCN-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.93
Rot. Bonds

About cyclooctane;methylcyclobutane

cyclooctane;methylcyclobutane (PubChem CID 159456217) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is cyclooctane;methylcyclobutane.

Molecular Properties

Compound Namecyclooctane;methylcyclobutane
PubChem CID159456217
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Namecyclooctane;methylcyclobutane
SMILESC1CCCCCCC1.CC1CCC1
InChIInChI=1S/C8H16.C5H10/c1-2-4-6-8-7-5-3-1;1-5-3-2-4-5/h1-8H2;5H,2-4H2,1H3
InChIKeyLTZTXDHJZOBKCN-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

cyclobutane;cyclopropane;methylcyclobutane
CID 157419563
cyclobutane;cyclopropane;ethane;methylcyclobutane
CID 159641047
cyclobutane;ethane;methylcyclobutane
CID 158121682
1,5,9,13,17,21-hexamethylcyclotetracosane
CID 164675975
methane;methylcyclobutane;methylcyclohexane;methylcyclopentane
CID 159112389
cyclohexane;methylcyclopentane
CID 20788572
1,6-dimethylcycloundecane
CID 91298161
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
1,4-dimethylcycloheptane;1,4-dimethylcyclohexane;methane;methylcyclohexane
CID 161210516
methane;methylcyclohexane
CID 143705611
ethane;methylcyclohexane;methylcyclopentane
CID 159395989
gallane;methylcyclohexane
CID 174461507

Frequently Asked Questions

What is the IUPAC name of cyclooctane;methylcyclobutane?
The IUPAC name of cyclooctane;methylcyclobutane (CID 159456217) is cyclooctane;methylcyclobutane.
What is the SMILES notation for cyclooctane;methylcyclobutane?
The canonical SMILES for cyclooctane;methylcyclobutane is C1CCCCCCC1.CC1CCC1.
What is the InChIKey of cyclooctane;methylcyclobutane?
The InChIKey is LTZTXDHJZOBKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16.C5H10/c1-2-4-6-8-7-5-3-1;1-5-3-2-4-5/h1-8H2;5H,2-4H2,1H3.
What are the key properties of cyclooctane;methylcyclobutane?
cyclooctane;methylcyclobutane has a molecular weight of 182.35 g/mol, XLogP of 4.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctane;methylcyclobutane is sourced from PubChem (CID 159456217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).