1-fluoro-2-pent-4-en-2-yloxycyclopentene

C10H15FO — CID 66681240

IUPAC1-fluoro-2-pent-4-en-2-yloxycyclopentene
SMILESC=CCC(C)OC1=C(F)CCC1
InChIInChI=1S/C10H15FO/c1-3-5-8(2)12-10-7-4-6-9(10)11/h3,8H,1,4-7H2,2H3
InChIKeyIGRHAWCTWJKWTH-UHFFFAOYSA-N
MW170.23 g/mol
LogP3.33
Rot. Bonds4

About 1-fluoro-2-pent-4-en-2-yloxycyclopentene

1-fluoro-2-pent-4-en-2-yloxycyclopentene (PubChem CID 66681240) has the molecular formula C10H15FO and a molecular weight of 170.23 g/mol. Its IUPAC name is 1-fluoro-2-pent-4-en-2-yloxycyclopentene.

Molecular Properties

Compound Name1-fluoro-2-pent-4-en-2-yloxycyclopentene
PubChem CID66681240
Molecular FormulaC10H15FO
Molecular Weight170.23 g/mol
Exact Mass170.11
IUPAC Name1-fluoro-2-pent-4-en-2-yloxycyclopentene
SMILESC=CCC(C)OC1=C(F)CCC1
InChIInChI=1S/C10H15FO/c1-3-5-8(2)12-10-7-4-6-9(10)11/h3,8H,1,4-7H2,2H3
InChIKeyIGRHAWCTWJKWTH-UHFFFAOYSA-N
XLogP3.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.23
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-fluoro-2-pent-4-en-2-yloxycyclopentene?
The IUPAC name of 1-fluoro-2-pent-4-en-2-yloxycyclopentene (CID 66681240) is 1-fluoro-2-pent-4-en-2-yloxycyclopentene.
What is the SMILES notation for 1-fluoro-2-pent-4-en-2-yloxycyclopentene?
The canonical SMILES for 1-fluoro-2-pent-4-en-2-yloxycyclopentene is C=CCC(C)OC1=C(F)CCC1.
What is the InChIKey of 1-fluoro-2-pent-4-en-2-yloxycyclopentene?
The InChIKey is IGRHAWCTWJKWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FO/c1-3-5-8(2)12-10-7-4-6-9(10)11/h3,8H,1,4-7H2,2H3.
What are the key properties of 1-fluoro-2-pent-4-en-2-yloxycyclopentene?
1-fluoro-2-pent-4-en-2-yloxycyclopentene has a molecular weight of 170.23 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-pent-4-en-2-yloxycyclopentene is sourced from PubChem (CID 66681240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).