2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane

C9H15IO — CID 25187190

IUPAC2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane
SMILESC/C=C(\I)C1(CC)CCCO1
InChIInChI=1S/C9H15IO/c1-3-8(10)9(4-2)6-5-7-11-9/h3H,4-7H2,1-2H3/b8-3-
InChIKeyJEFDISXIMDHORV-BAQGIRSFSA-N
MW266.12 g/mol
LogP3.28
Rot. Bonds2

About 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane

2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane (PubChem CID 25187190) has the molecular formula C9H15IO and a molecular weight of 266.12 g/mol. Its IUPAC name is 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane.

Molecular Properties

Compound Name2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane
PubChem CID25187190
Molecular FormulaC9H15IO
Molecular Weight266.12 g/mol
Exact Mass266.02
IUPAC Name2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane
SMILESC/C=C(\I)C1(CC)CCCO1
InChIInChI=1S/C9H15IO/c1-3-8(10)9(4-2)6-5-7-11-9/h3H,4-7H2,1-2H3/b8-3-
InChIKeyJEFDISXIMDHORV-BAQGIRSFSA-N
XLogP3.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.12
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane?
The IUPAC name of 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane (CID 25187190) is 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane.
What is the SMILES notation for 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane?
The canonical SMILES for 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane is C/C=C(\I)C1(CC)CCCO1.
What is the InChIKey of 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane?
The InChIKey is JEFDISXIMDHORV-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H15IO/c1-3-8(10)9(4-2)6-5-7-11-9/h3H,4-7H2,1-2H3/b8-3-.
What are the key properties of 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane?
2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane has a molecular weight of 266.12 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[(Z)-1-iodoprop-1-enyl]oxolane is sourced from PubChem (CID 25187190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).