2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane

C20H38O5 — CID 155771365

IUPAC2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
SMILESC(CCOCCCCCOC1CCCCO1)CCOC1CCCCO1
InChIInChI=1S/C20H38O5/c1(7-15-22-19-11-3-9-17-24-19)5-13-21-14-6-2-8-16-23-20-12-4-10-18-25-20/h19-20H,1-18H2
InChIKeyDZOXKBSVBSETOI-UHFFFAOYSA-N
MW358.52 g/mol
LogP4.43
Rot. Bonds14

About 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane

2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane (PubChem CID 155771365) has the molecular formula C20H38O5 and a molecular weight of 358.52 g/mol. Its IUPAC name is 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane.

Molecular Properties

Compound Name2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
PubChem CID155771365
Molecular FormulaC20H38O5
Molecular Weight358.52 g/mol
Exact Mass358.27
IUPAC Name2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane
SMILESC(CCOCCCCCOC1CCCCO1)CCOC1CCCCO1
InChIInChI=1S/C20H38O5/c1(7-15-22-19-11-3-9-17-24-19)5-13-21-14-6-2-8-16-23-20-12-4-10-18-25-20/h19-20H,1-18H2
InChIKeyDZOXKBSVBSETOI-UHFFFAOYSA-N
XLogP4.43
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.52
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

18-(oxan-2-yloxy)octadecylphosphanium iodide
CID 157231904
2-(12-bromododecoxy)oxane
CID 11078592
2-octacosoxyoxane
CID 11214102
12-(oxan-2-yloxy)dodecan-1-amine
CID 170028710
2-(12-chlorododecoxy)oxane
CID 14014573
2-(18-iodooctadecoxy)oxane
CID 86124950
2-[3-(2-methoxyethoxy)propoxy]oxane
CID 158704924
2-(14-cyclobutyltetradecoxy)oxane
CID 151611436
(2S)-2-(3-chloropropoxy)oxane
CID 36690971
2-[5-(oxiran-2-yl)pentoxy]oxane
CID 169009121
trimethyl-[13-(oxan-2-yloxy)tridecyl]silane
CID 86200856
2-[6-(oxiran-2-yl)hexoxy]oxane
CID 177274031

Frequently Asked Questions

What is the IUPAC name of 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane?
The IUPAC name of 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane (CID 155771365) is 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane.
What is the SMILES notation for 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane?
The canonical SMILES for 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane is C(CCOCCCCCOC1CCCCO1)CCOC1CCCCO1.
What is the InChIKey of 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane?
The InChIKey is DZOXKBSVBSETOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O5/c1(7-15-22-19-11-3-9-17-24-19)5-13-21-14-6-2-8-16-23-20-12-4-10-18-25-20/h19-20H,1-18H2.
What are the key properties of 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane?
2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane has a molecular weight of 358.52 g/mol, XLogP of 4.43, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[5-(oxan-2-yloxy)pentoxy]pentoxy]oxane is sourced from PubChem (CID 155771365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).