2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine

C13H22FNO — CID 102648262

IUPAC2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine
SMILESCC(F)(CC1CCCCN1)C1=CCCCO1
InChIInChI=1S/C13H22FNO/c1-13(14,12-7-3-5-9-16-12)10-11-6-2-4-8-15-11/h7,11,15H,2-6,8-10H2,1H3
InChIKeyJGDCLZBEZYGIBU-UHFFFAOYSA-N
MW227.32 g/mol
LogP2.94
Rot. Bonds3

About 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine

2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine (PubChem CID 102648262) has the molecular formula C13H22FNO and a molecular weight of 227.32 g/mol. Its IUPAC name is 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine.

Molecular Properties

Compound Name2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine
PubChem CID102648262
Molecular FormulaC13H22FNO
Molecular Weight227.32 g/mol
Exact Mass227.17
IUPAC Name2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine
SMILESCC(F)(CC1CCCCN1)C1=CCCCO1
InChIInChI=1S/C13H22FNO/c1-13(14,12-7-3-5-9-16-12)10-11-6-2-4-8-15-11/h7,11,15H,2-6,8-10H2,1H3
InChIKeyJGDCLZBEZYGIBU-UHFFFAOYSA-N
XLogP2.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-dihydro-2H-pyran-6-yl)-3-fluoro-8-azabicyclo[3.2.1]octane
CID 102648247
3-[1-(3,4-dihydro-2H-pyran-6-yl)-1-fluoroethyl]piperidine
CID 102648248
3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
CID 102648250
3-(2,3-Dihydrofuran-5-yl)-3-fluoro-8-azabicyclo[3.2.1]octane
CID 102652370
2-[2-(2,3-Dihydrofuran-5-yl)-2-fluoropropyl]piperidine
CID 102652385
2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
CID 106634971
3-[2-(Cyclohexen-1-yl)-2-fluoropropyl]morpholine
CID 106655073
2-(3-Methoxypent-3-en-2-yl)piperidine
CID 123890246
2-(cyclohexen-1-yl)-N-ethyl-1-(oxan-4-yl)ethanamine
CID 116661923

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine?
The IUPAC name of 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine (CID 102648262) is 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine.
What is the SMILES notation for 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine?
The canonical SMILES for 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine is CC(F)(CC1CCCCN1)C1=CCCCO1.
What is the InChIKey of 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine?
The InChIKey is JGDCLZBEZYGIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22FNO/c1-13(14,12-7-3-5-9-16-12)10-11-6-2-4-8-15-11/h7,11,15H,2-6,8-10H2,1H3.
What are the key properties of 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine?
2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine has a molecular weight of 227.32 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine is sourced from PubChem (CID 102648262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).