1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene

C17H15FO — CID 141023551

IUPAC1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene
SMILESFc1ccc(Oc2cccc(C3=CCCC3)c2)cc1
InChIInChI=1S/C17H15FO/c18-15-8-10-16(11-9-15)19-17-7-3-6-14(12-17)13-4-1-2-5-13/h3-4,6-12H,1-2,5H2
InChIKeyRIHRHVXFEJAIIH-UHFFFAOYSA-N
MW254.30 g/mol
LogP5.19
Rot. Bonds3

About 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene

1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene (PubChem CID 141023551) has the molecular formula C17H15FO and a molecular weight of 254.30 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene
PubChem CID141023551
Molecular FormulaC17H15FO
Molecular Weight254.30 g/mol
Exact Mass254.11
IUPAC Name1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene
SMILESFc1ccc(Oc2cccc(C3=CCCC3)c2)cc1
InChIInChI=1S/C17H15FO/c18-15-8-10-16(11-9-15)19-17-7-3-6-14(12-17)13-4-1-2-5-13/h3-4,6-12H,1-2,5H2
InChIKeyRIHRHVXFEJAIIH-UHFFFAOYSA-N
XLogP5.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.30
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene?
The IUPAC name of 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene (CID 141023551) is 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene.
What is the SMILES notation for 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene?
The canonical SMILES for 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene is Fc1ccc(Oc2cccc(C3=CCCC3)c2)cc1.
What is the InChIKey of 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene?
The InChIKey is RIHRHVXFEJAIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FO/c18-15-8-10-16(11-9-15)19-17-7-3-6-14(12-17)13-4-1-2-5-13/h3-4,6-12H,1-2,5H2.
What are the key properties of 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene?
1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene has a molecular weight of 254.30 g/mol, XLogP of 5.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)-3-(4-fluorophenoxy)benzene is sourced from PubChem (CID 141023551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).