(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane

C11H22O2 — CID 70332513

IUPAC(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane
SMILESCCC1(C)CC[C@](C)(COC)CO1
InChIInChI=1S/C11H22O2/c1-5-11(3)7-6-10(2,8-12-4)9-13-11/h5-9H2,1-4H3/t10-,11?/m1/s1
InChIKeyXENCWMGMHYMOES-NFJWQWPMSA-N
MW186.29 g/mol
LogP2.62
Rot. Bonds3

About (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane

(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane (PubChem CID 70332513) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane.

Molecular Properties

Compound Name(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane
PubChem CID70332513
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane
SMILESCCC1(C)CC[C@](C)(COC)CO1
InChIInChI=1S/C11H22O2/c1-5-11(3)7-6-10(2,8-12-4)9-13-11/h5-9H2,1-4H3/t10-,11?/m1/s1
InChIKeyXENCWMGMHYMOES-NFJWQWPMSA-N
XLogP2.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane 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 (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane?
The IUPAC name of (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane (CID 70332513) is (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane.
What is the SMILES notation for (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane?
The canonical SMILES for (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane is CCC1(C)CC[C@](C)(COC)CO1.
What is the InChIKey of (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane?
The InChIKey is XENCWMGMHYMOES-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H22O2/c1-5-11(3)7-6-10(2,8-12-4)9-13-11/h5-9H2,1-4H3/t10-,11?/m1/s1.
What are the key properties of (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane?
(5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane has a molecular weight of 186.29 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-ethyl-5-(methoxymethyl)-2,5-dimethyloxane is sourced from PubChem (CID 70332513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).