4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine

C12H22FNO — CID 112563085

IUPAC4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine
SMILESFC1(CCCC2CCCO2)CCNCC1
InChIInChI=1S/C12H22FNO/c13-12(6-8-14-9-7-12)5-1-3-11-4-2-10-15-11/h11,14H,1-10H2
InChIKeyRHVUTVMDLDKETO-UHFFFAOYSA-N
MW215.31 g/mol
LogP2.43
Rot. Bonds4

About 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine

4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine (PubChem CID 112563085) has the molecular formula C12H22FNO and a molecular weight of 215.31 g/mol. Its IUPAC name is 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine.

Molecular Properties

Compound Name4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine
PubChem CID112563085
Molecular FormulaC12H22FNO
Molecular Weight215.31 g/mol
Exact Mass215.17
IUPAC Name4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine
SMILESFC1(CCCC2CCCO2)CCNCC1
InChIInChI=1S/C12H22FNO/c13-12(6-8-14-9-7-12)5-1-3-11-4-2-10-15-11/h11,14H,1-10H2
InChIKeyRHVUTVMDLDKETO-UHFFFAOYSA-N
XLogP2.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine?
The IUPAC name of 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine (CID 112563085) is 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine.
What is the SMILES notation for 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine?
The canonical SMILES for 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine is FC1(CCCC2CCCO2)CCNCC1.
What is the InChIKey of 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine?
The InChIKey is RHVUTVMDLDKETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22FNO/c13-12(6-8-14-9-7-12)5-1-3-11-4-2-10-15-11/h11,14H,1-10H2.
What are the key properties of 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine?
4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine has a molecular weight of 215.31 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-4-[3-(oxolan-2-yl)propyl]piperidine is sourced from PubChem (CID 112563085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).