3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine

C14H24FNO — CID 112562976

IUPAC3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine
SMILESFC1(C2CCOC3(CCCC3)C2)CCCNC1
InChIInChI=1S/C14H24FNO/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,16H,1-11H2
InChIKeyMLWCQSVTTJORDH-UHFFFAOYSA-N
MW241.35 g/mol
LogP2.82
Rot. Bonds1

About 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine

3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine (PubChem CID 112562976) has the molecular formula C14H24FNO and a molecular weight of 241.35 g/mol. Its IUPAC name is 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine.

Molecular Properties

Compound Name3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine
PubChem CID112562976
Molecular FormulaC14H24FNO
Molecular Weight241.35 g/mol
Exact Mass241.18
IUPAC Name3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine
SMILESFC1(C2CCOC3(CCCC3)C2)CCCNC1
InChIInChI=1S/C14H24FNO/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,16H,1-11H2
InChIKeyMLWCQSVTTJORDH-UHFFFAOYSA-N
XLogP2.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine?
The IUPAC name of 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine (CID 112562976) is 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine.
What is the SMILES notation for 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine?
The canonical SMILES for 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine is FC1(C2CCOC3(CCCC3)C2)CCCNC1.
What is the InChIKey of 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine?
The InChIKey is MLWCQSVTTJORDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24FNO/c15-14(7-3-8-16-11-14)12-4-9-17-13(10-12)5-1-2-6-13/h12,16H,1-11H2.
What are the key properties of 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine?
3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine has a molecular weight of 241.35 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(6-oxaspiro[4.5]decan-9-yl)piperidine is sourced from PubChem (CID 112562976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).