2-methoxy-2-pent-1-enyloxane

C11H20O2 — CID 67848315

IUPAC2-methoxy-2-pent-1-enyloxane
SMILESCCCC=CC1(OC)CCCCO1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3
InChIKeyOYUHJKMJJLAWNE-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.89
Rot. Bonds4

About 2-methoxy-2-pent-1-enyloxane

2-methoxy-2-pent-1-enyloxane (PubChem CID 67848315) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methoxy-2-pent-1-enyloxane.

Molecular Properties

Compound Name2-methoxy-2-pent-1-enyloxane
PubChem CID67848315
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-methoxy-2-pent-1-enyloxane
SMILESCCCC=CC1(OC)CCCCO1
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3
InChIKeyOYUHJKMJJLAWNE-UHFFFAOYSA-N
XLogP2.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.89
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-methoxy-2-pent-1-enyloxane?
The IUPAC name of 2-methoxy-2-pent-1-enyloxane (CID 67848315) is 2-methoxy-2-pent-1-enyloxane.
What is the SMILES notation for 2-methoxy-2-pent-1-enyloxane?
The canonical SMILES for 2-methoxy-2-pent-1-enyloxane is CCCC=CC1(OC)CCCCO1.
What is the InChIKey of 2-methoxy-2-pent-1-enyloxane?
The InChIKey is OYUHJKMJJLAWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-8-11(12-2)9-6-7-10-13-11/h5,8H,3-4,6-7,9-10H2,1-2H3.
What are the key properties of 2-methoxy-2-pent-1-enyloxane?
2-methoxy-2-pent-1-enyloxane has a molecular weight of 184.28 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-pent-1-enyloxane is sourced from PubChem (CID 67848315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).