2,6-diethyl-3,5-dimethyloxan-2-ol

C11H22O2 — CID 14522549

IUPAC2,6-diethyl-3,5-dimethyloxan-2-ol
SMILESCCC1OC(O)(CC)C(C)CC1C
InChIInChI=1S/C11H22O2/c1-5-10-8(3)7-9(4)11(12,6-2)13-10/h8-10,12H,5-7H2,1-4H3
InChIKeyQFLOEVQUUGAABV-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.56
Rot. Bonds2

About 2,6-diethyl-3,5-dimethyloxan-2-ol

2,6-diethyl-3,5-dimethyloxan-2-ol (PubChem CID 14522549) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2,6-diethyl-3,5-dimethyloxan-2-ol.

Molecular Properties

Compound Name2,6-diethyl-3,5-dimethyloxan-2-ol
PubChem CID14522549
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2,6-diethyl-3,5-dimethyloxan-2-ol
SMILESCCC1OC(O)(CC)C(C)CC1C
InChIInChI=1S/C11H22O2/c1-5-10-8(3)7-9(4)11(12,6-2)13-10/h8-10,12H,5-7H2,1-4H3
InChIKeyQFLOEVQUUGAABV-UHFFFAOYSA-N
XLogP2.56
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,6-diethyl-3,5-dimethyloxan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-3,5-dimethyloxan-2-ol?
The IUPAC name of 2,6-diethyl-3,5-dimethyloxan-2-ol (CID 14522549) is 2,6-diethyl-3,5-dimethyloxan-2-ol.
What is the SMILES notation for 2,6-diethyl-3,5-dimethyloxan-2-ol?
The canonical SMILES for 2,6-diethyl-3,5-dimethyloxan-2-ol is CCC1OC(O)(CC)C(C)CC1C.
What is the InChIKey of 2,6-diethyl-3,5-dimethyloxan-2-ol?
The InChIKey is QFLOEVQUUGAABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-5-10-8(3)7-9(4)11(12,6-2)13-10/h8-10,12H,5-7H2,1-4H3.
What are the key properties of 2,6-diethyl-3,5-dimethyloxan-2-ol?
2,6-diethyl-3,5-dimethyloxan-2-ol has a molecular weight of 186.29 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-3,5-dimethyloxan-2-ol is sourced from PubChem (CID 14522549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).