2-(2,2-dimethylpropyl)-6-methyloxane

C11H22O — CID 163432444

IUPAC2-(2,2-dimethylpropyl)-6-methyloxane
SMILESCC1CCCC(CC(C)(C)C)O1
InChIInChI=1S/C11H22O/c1-9-6-5-7-10(12-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyARRKOBWKLCTUFH-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.38
Rot. Bonds1

About 2-(2,2-dimethylpropyl)-6-methyloxane

2-(2,2-dimethylpropyl)-6-methyloxane (PubChem CID 163432444) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-6-methyloxane.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-6-methyloxane
PubChem CID163432444
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name2-(2,2-dimethylpropyl)-6-methyloxane
SMILESCC1CCCC(CC(C)(C)C)O1
InChIInChI=1S/C11H22O/c1-9-6-5-7-10(12-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyARRKOBWKLCTUFH-UHFFFAOYSA-N
XLogP3.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-(2,2-dimethylpropyl)oxolane
CID 58780523
(2R)-2-(2,2-dimethylpropyl)oxolane
CID 58780469
2,2-dimethylpropane;2,2-dimethylpropylcyclobutane
CID 167591215
2-methyl-6-(oxetan-3-ylmethyl)oxane
CID 146414314
2-(2,2-dimethylpropyl)oxolane;ethane
CID 155737583
2-cyclopropyl-2-methyl-3-(5-methyloxolan-2-yl)propan-1-amine
CID 103139001
(2R)-2-(2,2-dimethylpropyl)oxirane
CID 15053925
2-methyl-2-[(5-methyloxolan-2-yl)methyl]but-3-en-1-ol
CID 103142539
N-ethyl-2,2-dimethyl-3-(5-methyloxolan-2-yl)propan-1-amine
CID 103138418
2-[2-(bromomethyl)-2-methylbut-3-enyl]-5-methyloxolane
CID 103142758
1-(tert-butylamino)-2-methyl-3-(5-methyloxolan-2-yl)propan-2-ol
CID 103132323
2,6-dimethyloxane;2,4-dimethyloxetane;2,5-dimethyloxolane
CID 162224348

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-6-methyloxane?
The IUPAC name of 2-(2,2-dimethylpropyl)-6-methyloxane (CID 163432444) is 2-(2,2-dimethylpropyl)-6-methyloxane.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-6-methyloxane?
The canonical SMILES for 2-(2,2-dimethylpropyl)-6-methyloxane is CC1CCCC(CC(C)(C)C)O1.
What is the InChIKey of 2-(2,2-dimethylpropyl)-6-methyloxane?
The InChIKey is ARRKOBWKLCTUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-9-6-5-7-10(12-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 2-(2,2-dimethylpropyl)-6-methyloxane?
2-(2,2-dimethylpropyl)-6-methyloxane has a molecular weight of 170.30 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-6-methyloxane is sourced from PubChem (CID 163432444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).