2-pent-1-en-3-yloxyoxane

C10H18O2 — CID 14103515

IUPAC2-pent-1-en-3-yloxyoxane
SMILESC=CC(CC)OC1CCCCO1
InChIInChI=1S/C10H18O2/c1-3-9(4-2)12-10-7-5-6-8-11-10/h3,9-10H,1,4-8H2,2H3
InChIKeyXEKRKGHMYGPZHY-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.49
Rot. Bonds4

About 2-pent-1-en-3-yloxyoxane

2-pent-1-en-3-yloxyoxane (PubChem CID 14103515) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-pent-1-en-3-yloxyoxane.

Molecular Properties

Compound Name2-pent-1-en-3-yloxyoxane
PubChem CID14103515
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-pent-1-en-3-yloxyoxane
SMILESC=CC(CC)OC1CCCCO1
InChIInChI=1S/C10H18O2/c1-3-9(4-2)12-10-7-5-6-8-11-10/h3,9-10H,1,4-8H2,2H3
InChIKeyXEKRKGHMYGPZHY-UHFFFAOYSA-N
XLogP2.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-pent-1-en-3-yloxyoxane?
The IUPAC name of 2-pent-1-en-3-yloxyoxane (CID 14103515) is 2-pent-1-en-3-yloxyoxane.
What is the SMILES notation for 2-pent-1-en-3-yloxyoxane?
The canonical SMILES for 2-pent-1-en-3-yloxyoxane is C=CC(CC)OC1CCCCO1.
What is the InChIKey of 2-pent-1-en-3-yloxyoxane?
The InChIKey is XEKRKGHMYGPZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-9(4-2)12-10-7-5-6-8-11-10/h3,9-10H,1,4-8H2,2H3.
What are the key properties of 2-pent-1-en-3-yloxyoxane?
2-pent-1-en-3-yloxyoxane has a molecular weight of 170.25 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pent-1-en-3-yloxyoxane is sourced from PubChem (CID 14103515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).