cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane

C32H64 — CID 159227929

IUPACcyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
SMILESC1CCC1.C1CCCC1.C1CCCCCC1.C1CCCCCCC1.CCC1CCCCC1
InChIInChI=1S/2C8H16.C7H14.C5H10.C4H8/c1-2-8-6-4-3-5-7-8;1-2-4-6-8-7-5-3-1;1-2-4-6-7-5-3-1;1-2-4-5-3-1;1-2-4-3-1/h8H,2-7H2,1H3;1-8H2;1-7H2;1-5H2;1-4H2
InChIKeyKSNICQLEOQOQSJ-UHFFFAOYSA-N
MW448.86 g/mol
LogP12.34
Rot. Bonds1

About cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane

cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane (PubChem CID 159227929) has the molecular formula C32H64 and a molecular weight of 448.86 g/mol. Its IUPAC name is cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane.

Molecular Properties

Compound Namecyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
PubChem CID159227929
Molecular FormulaC32H64
Molecular Weight448.86 g/mol
Exact Mass448.50
IUPAC Namecyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
SMILESC1CCC1.C1CCCC1.C1CCCCCC1.C1CCCCCCC1.CCC1CCCCC1
InChIInChI=1S/2C8H16.C7H14.C5H10.C4H8/c1-2-8-6-4-3-5-7-8;1-2-4-6-8-7-5-3-1;1-2-4-6-7-5-3-1;1-2-4-5-3-1;1-2-4-3-1/h8H,2-7H2,1H3;1-8H2;1-7H2;1-5H2;1-4H2
InChIKeyKSNICQLEOQOQSJ-UHFFFAOYSA-N
XLogP12.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.86
LogP ≤ 512.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethylcyclooctane;fluoromethane
CID 174962953
ethylcyclopentane;methane
CID 143390575
tris(ethylcyclopentane);gadolinium
CID 160752471
ethane;bis(ethylcyclopentane)
CID 158911237
chromium;bis(ethylcyclopentane)
CID 91996240
ethylcyclohexane;formonitrile
CID 174889190
ethylcyclopentane;methanamine
CID 142068671
magnesium;carbanide;bis(ethylcyclopentane)
CID 121233150
carbanide;bis(ethylcyclopentane);tungsten dihydride
CID 164887185
cyclopropane;ethylcyclobutane;propane
CID 142456817
dimethoxymethane;ethylcyclohexane
CID 159138844
ethylcyclobutane;methanamine
CID 175532329

Frequently Asked Questions

What is the IUPAC name of cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane?
The IUPAC name of cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane (CID 159227929) is cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane.
What is the SMILES notation for cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane?
The canonical SMILES for cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane is C1CCC1.C1CCCC1.C1CCCCCC1.C1CCCCCCC1.CCC1CCCCC1.
What is the InChIKey of cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane?
The InChIKey is KSNICQLEOQOQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H16.C7H14.C5H10.C4H8/c1-2-8-6-4-3-5-7-8;1-2-4-6-8-7-5-3-1;1-2-4-6-7-5-3-1;1-2-4-5-3-1;1-2-4-3-1/h8H,2-7H2,1H3;1-8H2;1-7H2;1-5H2;1-4H2.
What are the key properties of cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane?
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane has a molecular weight of 448.86 g/mol, XLogP of 12.34, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane is sourced from PubChem (CID 159227929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).