1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene

C15H20O2 — CID 57238623

IUPAC1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene
SMILESC=Cc1ccc(OCCOC2CCCC2)cc1
InChIInChI=1S/C15H20O2/c1-2-13-7-9-15(10-8-13)17-12-11-16-14-5-3-4-6-14/h2,7-10,14H,1,3-6,11-12H2
InChIKeyHQUHKDIFSDWUSI-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.67
Rot. Bonds6

About 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene

1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene (PubChem CID 57238623) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene.

Molecular Properties

Compound Name1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene
PubChem CID57238623
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene
SMILESC=Cc1ccc(OCCOC2CCCC2)cc1
InChIInChI=1S/C15H20O2/c1-2-13-7-9-15(10-8-13)17-12-11-16-14-5-3-4-6-14/h2,7-10,14H,1,3-6,11-12H2
InChIKeyHQUHKDIFSDWUSI-UHFFFAOYSA-N
XLogP3.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene 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 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene?
The IUPAC name of 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene (CID 57238623) is 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene.
What is the SMILES notation for 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene?
The canonical SMILES for 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene is C=Cc1ccc(OCCOC2CCCC2)cc1.
What is the InChIKey of 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene?
The InChIKey is HQUHKDIFSDWUSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-2-13-7-9-15(10-8-13)17-12-11-16-14-5-3-4-6-14/h2,7-10,14H,1,3-6,11-12H2.
What are the key properties of 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene?
1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene has a molecular weight of 232.32 g/mol, XLogP of 3.67, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyloxyethoxy)-4-ethenylbenzene is sourced from PubChem (CID 57238623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).