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

C15H28O2 — CID 65166209

IUPAC4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol
SMILESCCC1CCC(O)C(CCCC2CCCO2)C1
InChIInChI=1S/C15H28O2/c1-2-12-8-9-15(16)13(11-12)5-3-6-14-7-4-10-17-14/h12-16H,2-11H2,1H3
InChIKeyRHEVXOAIHMNMHF-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.52
Rot. Bonds5

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

4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol (PubChem CID 65166209) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol
PubChem CID65166209
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol
SMILESCCC1CCC(O)C(CCCC2CCCO2)C1
InChIInChI=1S/C15H28O2/c1-2-12-8-9-15(16)13(11-12)5-3-6-14-7-4-10-17-14/h12-16H,2-11H2,1H3
InChIKeyRHEVXOAIHMNMHF-UHFFFAOYSA-N
XLogP3.52
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol (CID 65166209) is 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol is CCC1CCC(O)C(CCCC2CCCO2)C1.
What is the InChIKey of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The InChIKey is RHEVXOAIHMNMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-12-8-9-15(16)13(11-12)5-3-6-14-7-4-10-17-14/h12-16H,2-11H2,1H3.
What are the key properties of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol is sourced from PubChem (CID 65166209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).