4,4-difluoro-1-(furan-3-yl)piperidine

C9H11F2NO — CID 175988490

IUPAC4,4-difluoro-1-(furan-3-yl)piperidine
SMILESFC1(F)CCN(c2ccoc2)CC1
InChIInChI=1S/C9H11F2NO/c10-9(11)2-4-12(5-3-9)8-1-6-13-7-8/h1,6-7H,2-5H2
InChIKeyNBDRRFVSOKJYAO-UHFFFAOYSA-N
MW187.19 g/mol
LogP2.52
Rot. Bonds1

About 4,4-difluoro-1-(furan-3-yl)piperidine

4,4-difluoro-1-(furan-3-yl)piperidine (PubChem CID 175988490) has the molecular formula C9H11F2NO and a molecular weight of 187.19 g/mol. Its IUPAC name is 4,4-difluoro-1-(furan-3-yl)piperidine.

Molecular Properties

Compound Name4,4-difluoro-1-(furan-3-yl)piperidine
PubChem CID175988490
Molecular FormulaC9H11F2NO
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name4,4-difluoro-1-(furan-3-yl)piperidine
SMILESFC1(F)CCN(c2ccoc2)CC1
InChIInChI=1S/C9H11F2NO/c10-9(11)2-4-12(5-3-9)8-1-6-13-7-8/h1,6-7H,2-5H2
InChIKeyNBDRRFVSOKJYAO-UHFFFAOYSA-N
XLogP2.52
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Ammonium, (3-furyl)trimethyl-, iodide
CID 199990
4-(Furan-3-yl)morpholine
CID 12009355
Furan-3-yl(trimethyl)azanium
CID 199991
N-(2-fluoroethyl)furan-3-amine
CID 140143628
N-(2,2-difluoroethyl)furan-3-amine
CID 151412690
1-(furan-3-yl)-3-(trifluoromethyl)-2H-imidazole
CID 174593433
[4-(aminomethyl)-1-(furan-3-yl)-2H-pyridin-2-yl] 2,2,2-trifluoroacetate
CID 42625748
N,N-diethylfuran-3-amine
CID 12009356
N-butylfuran-3-amine
CID 12009357
1-(Furan-3-yl)pyrrolidine
CID 18364766
1-(Furan-3-yl)pyridin-4-one
CID 19788565
1-(furan-3-yl)-4H-pyridine
CID 20037028

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-1-(furan-3-yl)piperidine?
The IUPAC name of 4,4-difluoro-1-(furan-3-yl)piperidine (CID 175988490) is 4,4-difluoro-1-(furan-3-yl)piperidine.
What is the SMILES notation for 4,4-difluoro-1-(furan-3-yl)piperidine?
The canonical SMILES for 4,4-difluoro-1-(furan-3-yl)piperidine is FC1(F)CCN(c2ccoc2)CC1.
What is the InChIKey of 4,4-difluoro-1-(furan-3-yl)piperidine?
The InChIKey is NBDRRFVSOKJYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO/c10-9(11)2-4-12(5-3-9)8-1-6-13-7-8/h1,6-7H,2-5H2.
What are the key properties of 4,4-difluoro-1-(furan-3-yl)piperidine?
4,4-difluoro-1-(furan-3-yl)piperidine has a molecular weight of 187.19 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-1-(furan-3-yl)piperidine is sourced from PubChem (CID 175988490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).