1-cyclopentyl-2-fluorobenzene

C11H13F — CID 53415938

IUPAC1-cyclopentyl-2-fluorobenzene
SMILESFc1ccccc1C1CCCC1
InChIInChI=1S/C11H13F/c12-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2
InChIKeyCJPHNFSDVUFVRO-UHFFFAOYSA-N
MW164.22 g/mol
LogP3.48
Rot. Bonds1

About 1-cyclopentyl-2-fluorobenzene

1-cyclopentyl-2-fluorobenzene (PubChem CID 53415938) has the molecular formula C11H13F and a molecular weight of 164.22 g/mol. Its IUPAC name is 1-cyclopentyl-2-fluorobenzene.

Molecular Properties

Compound Name1-cyclopentyl-2-fluorobenzene
PubChem CID53415938
Molecular FormulaC11H13F
Molecular Weight164.22 g/mol
Exact Mass164.10
IUPAC Name1-cyclopentyl-2-fluorobenzene
SMILESFc1ccccc1C1CCCC1
InChIInChI=1S/C11H13F/c12-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2
InChIKeyCJPHNFSDVUFVRO-UHFFFAOYSA-N
XLogP3.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.22
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-fluorobenzene?
The IUPAC name of 1-cyclopentyl-2-fluorobenzene (CID 53415938) is 1-cyclopentyl-2-fluorobenzene.
What is the SMILES notation for 1-cyclopentyl-2-fluorobenzene?
The canonical SMILES for 1-cyclopentyl-2-fluorobenzene is Fc1ccccc1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-fluorobenzene?
The InChIKey is CJPHNFSDVUFVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F/c12-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2.
What are the key properties of 1-cyclopentyl-2-fluorobenzene?
1-cyclopentyl-2-fluorobenzene has a molecular weight of 164.22 g/mol, XLogP of 3.48, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-fluorobenzene is sourced from PubChem (CID 53415938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).