2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol

C15H28O2 — CID 62383405

IUPAC2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol
SMILESCCC1CCC(O)C(OCC2CCCCC2)C1
InChIInChI=1S/C15H28O2/c1-2-12-8-9-14(16)15(10-12)17-11-13-6-4-3-5-7-13/h12-16H,2-11H2,1H3
InChIKeyMXOGEJVZNLXPFU-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.52
Rot. Bonds4

About 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol

2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol (PubChem CID 62383405) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol
PubChem CID62383405
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol
SMILESCCC1CCC(O)C(OCC2CCCCC2)C1
InChIInChI=1S/C15H28O2/c1-2-12-8-9-14(16)15(10-12)17-11-13-6-4-3-5-7-13/h12-16H,2-11H2,1H3
InChIKeyMXOGEJVZNLXPFU-UHFFFAOYSA-N
XLogP3.52
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol?
The IUPAC name of 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol (CID 62383405) is 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol.
What is the SMILES notation for 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol?
The canonical SMILES for 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol is CCC1CCC(O)C(OCC2CCCCC2)C1.
What is the InChIKey of 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol?
The InChIKey is MXOGEJVZNLXPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-12-8-9-14(16)15(10-12)17-11-13-6-4-3-5-7-13/h12-16H,2-11H2,1H3.
What are the key properties of 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol?
2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethoxy)-4-ethylcyclohexan-1-ol is sourced from PubChem (CID 62383405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).