1-ethyl-4-methylcyclooctane;methane

C12H26 — CID 159989571

IUPAC1-ethyl-4-methylcyclooctane;methane
SMILESC.CCC1CCCCC(C)CC1
InChIInChI=1S/C11H22.CH4/c1-3-11-7-5-4-6-10(2)8-9-11;/h10-11H,3-9H2,1-2H3;1H4
InChIKeyOGTWLZOWGJPADS-UHFFFAOYSA-N
MW170.34 g/mol
LogP4.64
Rot. Bonds1

About 1-ethyl-4-methylcyclooctane;methane

1-ethyl-4-methylcyclooctane;methane (PubChem CID 159989571) has the molecular formula C12H26 and a molecular weight of 170.34 g/mol. Its IUPAC name is 1-ethyl-4-methylcyclooctane;methane.

Molecular Properties

Compound Name1-ethyl-4-methylcyclooctane;methane
PubChem CID159989571
Molecular FormulaC12H26
Molecular Weight170.34 g/mol
Exact Mass170.20
IUPAC Name1-ethyl-4-methylcyclooctane;methane
SMILESC.CCC1CCCCC(C)CC1
InChIInChI=1S/C11H22.CH4/c1-3-11-7-5-4-6-10(2)8-9-11;/h10-11H,3-9H2,1-2H3;1H4
InChIKeyOGTWLZOWGJPADS-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.34
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-ethyl-1,7-dimethylcyclododecane
CID 123234850
carbanide;ethylcyclopentane;methylcyclopentane;ruthenium(2+)
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1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexane;methane
CID 160789108
cyclobutane;ethane;ethylcyclobutane;methane;methylcyclobutane
CID 158476891
1-ethyl-4-methylcyclohexane;pentane
CID 159787850
1-ethyl-4-(4-methylcyclohexyl)cyclohexane
CID 19850420
1,4-diethylcyclohexane;1-methyl-4-[2-(4-methylcyclohexyl)propan-2-yl]cyclohexane
CID 163450163
chromium;bis(ethylcyclopentane)
CID 91996240
tris(ethylcyclopentane);gadolinium
CID 160752471
butane;methylcyclopentane
CID 142053859
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methylcyclooctane;methane?
The IUPAC name of 1-ethyl-4-methylcyclooctane;methane (CID 159989571) is 1-ethyl-4-methylcyclooctane;methane.
What is the SMILES notation for 1-ethyl-4-methylcyclooctane;methane?
The canonical SMILES for 1-ethyl-4-methylcyclooctane;methane is C.CCC1CCCCC(C)CC1.
What is the InChIKey of 1-ethyl-4-methylcyclooctane;methane?
The InChIKey is OGTWLZOWGJPADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.CH4/c1-3-11-7-5-4-6-10(2)8-9-11;/h10-11H,3-9H2,1-2H3;1H4.
What are the key properties of 1-ethyl-4-methylcyclooctane;methane?
1-ethyl-4-methylcyclooctane;methane has a molecular weight of 170.34 g/mol, XLogP of 4.64, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methylcyclooctane;methane is sourced from PubChem (CID 159989571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).