2-(cyclopentylmethyl)-4-fluorooxane

C11H19FO — CID 130286251

IUPAC2-(cyclopentylmethyl)-4-fluorooxane
SMILESFC1CCOC(CC2CCCC2)C1
InChIInChI=1S/C11H19FO/c12-10-5-6-13-11(8-10)7-9-3-1-2-4-9/h9-11H,1-8H2
InChIKeyULCHEDIOYPLWHH-UHFFFAOYSA-N
MW186.27 g/mol
LogP3.08
Rot. Bonds2

About 2-(cyclopentylmethyl)-4-fluorooxane

2-(cyclopentylmethyl)-4-fluorooxane (PubChem CID 130286251) has the molecular formula C11H19FO and a molecular weight of 186.27 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-4-fluorooxane.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-4-fluorooxane
PubChem CID130286251
Molecular FormulaC11H19FO
Molecular Weight186.27 g/mol
Exact Mass186.14
IUPAC Name2-(cyclopentylmethyl)-4-fluorooxane
SMILESFC1CCOC(CC2CCCC2)C1
InChIInChI=1S/C11H19FO/c12-10-5-6-13-11(8-10)7-9-3-1-2-4-9/h9-11H,1-8H2
InChIKeyULCHEDIOYPLWHH-UHFFFAOYSA-N
XLogP3.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethyl)-4-fluorooxane?
The IUPAC name of 2-(cyclopentylmethyl)-4-fluorooxane (CID 130286251) is 2-(cyclopentylmethyl)-4-fluorooxane.
What is the SMILES notation for 2-(cyclopentylmethyl)-4-fluorooxane?
The canonical SMILES for 2-(cyclopentylmethyl)-4-fluorooxane is FC1CCOC(CC2CCCC2)C1.
What is the InChIKey of 2-(cyclopentylmethyl)-4-fluorooxane?
The InChIKey is ULCHEDIOYPLWHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FO/c12-10-5-6-13-11(8-10)7-9-3-1-2-4-9/h9-11H,1-8H2.
What are the key properties of 2-(cyclopentylmethyl)-4-fluorooxane?
2-(cyclopentylmethyl)-4-fluorooxane has a molecular weight of 186.27 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-4-fluorooxane is sourced from PubChem (CID 130286251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).