cyclooctyl-(4-ethylcyclohexyl)methanol

C17H32O — CID 80602985

IUPACcyclooctyl-(4-ethylcyclohexyl)methanol
SMILESCCC1CCC(C(O)C2CCCCCCC2)CC1
InChIInChI=1S/C17H32O/c1-2-14-10-12-16(13-11-14)17(18)15-8-6-4-3-5-7-9-15/h14-18H,2-13H2,1H3
InChIKeyIHQGPQJNYQNNCD-UHFFFAOYSA-N
MW252.44 g/mol
LogP4.92
Rot. Bonds3

About cyclooctyl-(4-ethylcyclohexyl)methanol

cyclooctyl-(4-ethylcyclohexyl)methanol (PubChem CID 80602985) has the molecular formula C17H32O and a molecular weight of 252.44 g/mol. Its IUPAC name is cyclooctyl-(4-ethylcyclohexyl)methanol.

Molecular Properties

Compound Namecyclooctyl-(4-ethylcyclohexyl)methanol
PubChem CID80602985
Molecular FormulaC17H32O
Molecular Weight252.44 g/mol
Exact Mass252.25
IUPAC Namecyclooctyl-(4-ethylcyclohexyl)methanol
SMILESCCC1CCC(C(O)C2CCCCCCC2)CC1
InChIInChI=1S/C17H32O/c1-2-14-10-12-16(13-11-14)17(18)15-8-6-4-3-5-7-9-15/h14-18H,2-13H2,1H3
InChIKeyIHQGPQJNYQNNCD-UHFFFAOYSA-N
XLogP4.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.44
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexyl-(4-ethylcyclohexyl)methanol
CID 64749927
cyclopentyl-(3-ethylcyclopentyl)methanol
CID 65410347
1-ethyl-4-propan-2-ylcyclohexane;propan-2-ylcycloheptane;propan-2-ylcyclopentane
CID 159304571
cyclooctyl(cyclopropyl)methanol
CID 80603317
cyclopropyl-(3-ethylcyclopentyl)methanol
CID 65411720
cyclohexyl-(4-pentylcyclohexyl)methanol
CID 141212039
(3-ethylcyclohexyl)-(4-propylcyclohexyl)methanol
CID 65423709
N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine
CID 65399653
2,2-dicyclopropyl-1-(4-ethylcyclohexyl)ethanol
CID 112743634
cyclobutane;cycloheptane;cyclooctane;cyclopentane;ethylcyclohexane
CID 159227929
2-cyclohexyl-1-(4-ethylcyclohexyl)ethanamine
CID 65394351
1-[cyclohexyl(hydroxy)methyl]-4-ethylcyclohexane-1-carbonitrile
CID 79137432

Frequently Asked Questions

What is the IUPAC name of cyclooctyl-(4-ethylcyclohexyl)methanol?
The IUPAC name of cyclooctyl-(4-ethylcyclohexyl)methanol (CID 80602985) is cyclooctyl-(4-ethylcyclohexyl)methanol.
What is the SMILES notation for cyclooctyl-(4-ethylcyclohexyl)methanol?
The canonical SMILES for cyclooctyl-(4-ethylcyclohexyl)methanol is CCC1CCC(C(O)C2CCCCCCC2)CC1.
What is the InChIKey of cyclooctyl-(4-ethylcyclohexyl)methanol?
The InChIKey is IHQGPQJNYQNNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O/c1-2-14-10-12-16(13-11-14)17(18)15-8-6-4-3-5-7-9-15/h14-18H,2-13H2,1H3.
What are the key properties of cyclooctyl-(4-ethylcyclohexyl)methanol?
cyclooctyl-(4-ethylcyclohexyl)methanol has a molecular weight of 252.44 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctyl-(4-ethylcyclohexyl)methanol is sourced from PubChem (CID 80602985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).