4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol

C12H22O2 — CID 79422205

IUPAC4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol
SMILESCCC1CCC(O)C(C2CCOC2)C1
InChIInChI=1S/C12H22O2/c1-2-9-3-4-12(13)11(7-9)10-5-6-14-8-10/h9-13H,2-8H2,1H3
InChIKeyLSVVHWORPDOYQZ-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.21
Rot. Bonds2

About 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol

4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol (PubChem CID 79422205) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol
PubChem CID79422205
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol
SMILESCCC1CCC(O)C(C2CCOC2)C1
InChIInChI=1S/C12H22O2/c1-2-9-3-4-12(13)11(7-9)10-5-6-14-8-10/h9-13H,2-8H2,1H3
InChIKeyLSVVHWORPDOYQZ-UHFFFAOYSA-N
XLogP2.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(oxolan-3-yl)oxan-4-ol
CID 106471116
3-ethyloxolane
CID 10996972
4-ethyl-2-[methyl(oxan-4-ylmethyl)amino]cyclohexan-1-ol
CID 63712306
N-[[4-ethyl-2-(oxan-4-yl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81029514
butane;3-ethyloxolane
CID 143075797
N-[[2-(oxolan-3-yl)cyclopropyl]methyl]ethanamine
CID 62704217
4-ethyltricyclo[6.2.1.02,7]undec-9-ene
CID 139995922
1,3-diethylcyclopentane
CID 530396
2-[(2E)-cyclooct-2-en-1-yl]-4-ethylcyclohexan-1-ol
CID 114228056
3-(2-bicyclo[2.2.0]hexanyl)oxolane
CID 163700457
4-(oxolan-3-yl)thiolan-3-ol
CID 83191232
2-dodecyl-4-ethylcyclohexan-1-ol
CID 63461251

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol?
The IUPAC name of 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol (CID 79422205) is 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol is CCC1CCC(O)C(C2CCOC2)C1.
What is the InChIKey of 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol?
The InChIKey is LSVVHWORPDOYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2/c1-2-9-3-4-12(13)11(7-9)10-5-6-14-8-10/h9-13H,2-8H2,1H3.
What are the key properties of 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol?
4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(oxolan-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 79422205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).