4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine

C16H22FNO — CID 58772142

IUPAC4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine
SMILESFc1ccccc1C1CCN(C2CCOCC2)CC1
InChIInChI=1S/C16H22FNO/c17-16-4-2-1-3-15(16)13-5-9-18(10-6-13)14-7-11-19-12-8-14/h1-4,13-14H,5-12H2
InChIKeyYSHNVBLYGQAUFG-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.18
Rot. Bonds2

About 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine

4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine (PubChem CID 58772142) has the molecular formula C16H22FNO and a molecular weight of 263.36 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine
PubChem CID58772142
Molecular FormulaC16H22FNO
Molecular Weight263.36 g/mol
Exact Mass263.17
IUPAC Name4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine
SMILESFc1ccccc1C1CCN(C2CCOCC2)CC1
InChIInChI=1S/C16H22FNO/c17-16-4-2-1-3-15(16)13-5-9-18(10-6-13)14-7-11-19-12-8-14/h1-4,13-14H,5-12H2
InChIKeyYSHNVBLYGQAUFG-UHFFFAOYSA-N
XLogP3.18
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine?
The IUPAC name of 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine (CID 58772142) is 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine.
What is the SMILES notation for 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine?
The canonical SMILES for 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine is Fc1ccccc1C1CCN(C2CCOCC2)CC1.
What is the InChIKey of 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine?
The InChIKey is YSHNVBLYGQAUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO/c17-16-4-2-1-3-15(16)13-5-9-18(10-6-13)14-7-11-19-12-8-14/h1-4,13-14H,5-12H2.
What are the key properties of 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine?
4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine has a molecular weight of 263.36 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-1-(oxan-4-yl)piperidine is sourced from PubChem (CID 58772142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).