1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene

C11H14F4O — CID 162536338

IUPAC1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene
SMILESCCCOC(C1=CCCC1)=C(F)C(F)(F)F
InChIInChI=1S/C11H14F4O/c1-2-7-16-9(8-5-3-4-6-8)10(12)11(13,14)15/h5H,2-4,6-7H2,1H3
InChIKeyRIYXMCKXJONARN-UHFFFAOYSA-N
MW238.22 g/mol
LogP4.27
Rot. Bonds4

About 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene

1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene (PubChem CID 162536338) has the molecular formula C11H14F4O and a molecular weight of 238.22 g/mol. Its IUPAC name is 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene.

Molecular Properties

Compound Name1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene
PubChem CID162536338
Molecular FormulaC11H14F4O
Molecular Weight238.22 g/mol
Exact Mass238.10
IUPAC Name1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene
SMILESCCCOC(C1=CCCC1)=C(F)C(F)(F)F
InChIInChI=1S/C11H14F4O/c1-2-7-16-9(8-5-3-4-6-8)10(12)11(13,14)15/h5H,2-4,6-7H2,1H3
InChIKeyRIYXMCKXJONARN-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.22
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene 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-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene?
The IUPAC name of 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene (CID 162536338) is 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene.
What is the SMILES notation for 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene?
The canonical SMILES for 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene is CCCOC(C1=CCCC1)=C(F)C(F)(F)F.
What is the InChIKey of 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene?
The InChIKey is RIYXMCKXJONARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F4O/c1-2-7-16-9(8-5-3-4-6-8)10(12)11(13,14)15/h5H,2-4,6-7H2,1H3.
What are the key properties of 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene?
1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene has a molecular weight of 238.22 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,3,3-tetrafluoro-1-propoxyprop-1-enyl)cyclopentene is sourced from PubChem (CID 162536338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).