cyclobutane;ethane;methane

C16H46 — CID 159400168

IUPACcyclobutane;ethane;methane
SMILESC.C.C1CCC1.CC.CC.CC.CC.CC
InChIInChI=1S/C4H8.5C2H6.2CH4/c1-2-4-3-1;5*1-2;;/h1-4H2;5*1-2H3;2*1H4
InChIKeyLNFUXYBVIPEFGE-UHFFFAOYSA-N
MW238.54 g/mol
LogP7.96
Rot. Bonds

About cyclobutane;ethane;methane

cyclobutane;ethane;methane (PubChem CID 159400168) has the molecular formula C16H46 and a molecular weight of 238.54 g/mol. Its IUPAC name is cyclobutane;ethane;methane.

Molecular Properties

Compound Namecyclobutane;ethane;methane
PubChem CID159400168
Molecular FormulaC16H46
Molecular Weight238.54 g/mol
Exact Mass238.36
IUPAC Namecyclobutane;ethane;methane
SMILESC.C.C1CCC1.CC.CC.CC.CC.CC
InChIInChI=1S/C4H8.5C2H6.2CH4/c1-2-4-3-1;5*1-2;;/h1-4H2;5*1-2H3;2*1H4
InChIKeyLNFUXYBVIPEFGE-UHFFFAOYSA-N
XLogP7.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.54
LogP ≤ 57.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

cyclohexane;cyclopentane;ethane;methane
CID 161306107
cyclobutane;ethane;methane
CID 161109968
cyclopropane;ethane
CID 160958790
cyclopropane;ethane
CID 144519947
cyclobutane;ethane
CID 91611118
cyclobutane;cyclohexane;ethane
CID 159889841
cyclopropane;ethane
CID 143364855
cyclopropane;ethane
CID 158116673
cyclopropane;ethane
CID 158590246
cyclopropane;ethane
CID 167628168
cyclobutane;ethane;hydroiodide
CID 144521095
cycloheptane;methane
CID 160881115

Frequently Asked Questions

What is the IUPAC name of cyclobutane;ethane;methane?
The IUPAC name of cyclobutane;ethane;methane (CID 159400168) is cyclobutane;ethane;methane.
What is the SMILES notation for cyclobutane;ethane;methane?
The canonical SMILES for cyclobutane;ethane;methane is C.C.C1CCC1.CC.CC.CC.CC.CC.
What is the InChIKey of cyclobutane;ethane;methane?
The InChIKey is LNFUXYBVIPEFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.5C2H6.2CH4/c1-2-4-3-1;5*1-2;;/h1-4H2;5*1-2H3;2*1H4.
What are the key properties of cyclobutane;ethane;methane?
cyclobutane;ethane;methane has a molecular weight of 238.54 g/mol, XLogP of 7.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutane;ethane;methane is sourced from PubChem (CID 159400168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).