4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine

C12H22FNO — CID 112563841

IUPAC4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine
SMILESFC(CCC1CCCO1)C1CCNCC1
InChIInChI=1S/C12H22FNO/c13-12(10-5-7-14-8-6-10)4-3-11-2-1-9-15-11/h10-12,14H,1-9H2
InChIKeyGDIHFTLVIDJXTC-UHFFFAOYSA-N
MW215.31 g/mol
LogP2.28
Rot. Bonds4

About 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine

4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine (PubChem CID 112563841) has the molecular formula C12H22FNO and a molecular weight of 215.31 g/mol. Its IUPAC name is 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine.

Molecular Properties

Compound Name4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine
PubChem CID112563841
Molecular FormulaC12H22FNO
Molecular Weight215.31 g/mol
Exact Mass215.17
IUPAC Name4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine
SMILESFC(CCC1CCCO1)C1CCNCC1
InChIInChI=1S/C12H22FNO/c13-12(10-5-7-14-8-6-10)4-3-11-2-1-9-15-11/h10-12,14H,1-9H2
InChIKeyGDIHFTLVIDJXTC-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine?
The IUPAC name of 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine (CID 112563841) is 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine.
What is the SMILES notation for 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine?
The canonical SMILES for 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine is FC(CCC1CCCO1)C1CCNCC1.
What is the InChIKey of 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine?
The InChIKey is GDIHFTLVIDJXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22FNO/c13-12(10-5-7-14-8-6-10)4-3-11-2-1-9-15-11/h10-12,14H,1-9H2.
What are the key properties of 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine?
4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine has a molecular weight of 215.31 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-fluoro-3-(oxolan-2-yl)propyl]piperidine is sourced from PubChem (CID 112563841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).