2-[(2R)-2-methylpentoxy]oxane

C11H22O2 — CID 57327472

IUPAC2-[(2R)-2-methylpentoxy]oxane
SMILESCCC[C@@H](C)COC1CCCCO1
InChIInChI=1S/C11H22O2/c1-3-6-10(2)9-13-11-7-4-5-8-12-11/h10-11H,3-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyUYCCNIAULQGKRT-NFJWQWPMSA-N
MW186.29 g/mol
LogP2.97
Rot. Bonds5

About 2-[(2R)-2-methylpentoxy]oxane

2-[(2R)-2-methylpentoxy]oxane (PubChem CID 57327472) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-[(2R)-2-methylpentoxy]oxane.

Molecular Properties

Compound Name2-[(2R)-2-methylpentoxy]oxane
PubChem CID57327472
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-[(2R)-2-methylpentoxy]oxane
SMILESCCC[C@@H](C)COC1CCCCO1
InChIInChI=1S/C11H22O2/c1-3-6-10(2)9-13-11-7-4-5-8-12-11/h10-11H,3-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyUYCCNIAULQGKRT-NFJWQWPMSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R)-4-iodo-2-methylbutoxy]oxane
CID 11779415
2-(2-propylpentoxy)oxane
CID 175998246
2,6-dimethyl-7-(oxan-2-yloxy)heptan-1-ol
CID 85158047
hydrazine;2-[(2R)-2-methylbutoxy]oxane;(3R)-3-methyl-4-(oxan-2-yloxy)butan-1-amine;hydrate
CID 158281779
4-amino-2-methylbutan-1-ol;3-methyl-4-(oxan-2-yloxy)butan-1-amine
CID 159084006
(6S)-6-methyl-7-(oxan-2-yloxy)heptan-2-one
CID 11622725
2-(2-methylpent-4-ynoxy)oxane
CID 143125735
2-[(15S)-15-methylpentacosoxy]oxane
CID 71379039
3-methyl-4-(oxan-2-yloxy)butanal
CID 58732523
(2R,5R)-2-(1-deuterioethyl)-5-methyl-6-(oxan-2-yloxy)hexane-1,2-diol
CID 10400448
2-(3-methylpentoxy)oxane
CID 14309360
2-(2,3,3-trimethylbutoxy)oxane
CID 145356481

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-methylpentoxy]oxane?
The IUPAC name of 2-[(2R)-2-methylpentoxy]oxane (CID 57327472) is 2-[(2R)-2-methylpentoxy]oxane.
What is the SMILES notation for 2-[(2R)-2-methylpentoxy]oxane?
The canonical SMILES for 2-[(2R)-2-methylpentoxy]oxane is CCC[C@@H](C)COC1CCCCO1.
What is the InChIKey of 2-[(2R)-2-methylpentoxy]oxane?
The InChIKey is UYCCNIAULQGKRT-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H22O2/c1-3-6-10(2)9-13-11-7-4-5-8-12-11/h10-11H,3-9H2,1-2H3/t10-,11?/m1/s1.
What are the key properties of 2-[(2R)-2-methylpentoxy]oxane?
2-[(2R)-2-methylpentoxy]oxane has a molecular weight of 186.29 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-methylpentoxy]oxane is sourced from PubChem (CID 57327472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).