4,4-difluoro-3-methoxypiperidine

C6H11F2NO — CID 58110386

IUPAC4,4-difluoro-3-methoxypiperidine
SMILESCOC1CNCCC1(F)F
InChIInChI=1S/C6H11F2NO/c1-10-5-4-9-3-2-6(5,7)8/h5,9H,2-4H2,1H3
InChIKeyVIEUHCZGUIDMMV-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.63
Rot. Bonds1

About 4,4-difluoro-3-methoxypiperidine

4,4-difluoro-3-methoxypiperidine (PubChem CID 58110386) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 4,4-difluoro-3-methoxypiperidine.

Molecular Properties

Compound Name4,4-difluoro-3-methoxypiperidine
PubChem CID58110386
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name4,4-difluoro-3-methoxypiperidine
SMILESCOC1CNCCC1(F)F
InChIInChI=1S/C6H11F2NO/c1-10-5-4-9-3-2-6(5,7)8/h5,9H,2-4H2,1H3
InChIKeyVIEUHCZGUIDMMV-UHFFFAOYSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methoxypiperidine
CID 4341744
3-Ethoxypiperidine
CID 4341745
3-Propoxypiperidine
CID 4712034
2-Propylmorpholine
CID 20205646
3-(Difluoromethoxy)piperidine
CID 47003318
3-(Propan-2-yloxy)piperidine
CID 53409756
4-(Difluoromethoxy)piperidine
CID 57791849
3-Methoxypiperidine hydrochloride
CID 23142000
(3R)-3-ethoxypiperidine
CID 40607156
2-Methyl-6-(trifluoromethyl)morpholine
CID 63901303
(3S)-3-methoxypiperidine hydrochloride
CID 67332844
2-(Difluoromethyl)morpholine
CID 68846218

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-3-methoxypiperidine?
The IUPAC name of 4,4-difluoro-3-methoxypiperidine (CID 58110386) is 4,4-difluoro-3-methoxypiperidine.
What is the SMILES notation for 4,4-difluoro-3-methoxypiperidine?
The canonical SMILES for 4,4-difluoro-3-methoxypiperidine is COC1CNCCC1(F)F.
What is the InChIKey of 4,4-difluoro-3-methoxypiperidine?
The InChIKey is VIEUHCZGUIDMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-10-5-4-9-3-2-6(5,7)8/h5,9H,2-4H2,1H3.
What are the key properties of 4,4-difluoro-3-methoxypiperidine?
4,4-difluoro-3-methoxypiperidine has a molecular weight of 151.16 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-3-methoxypiperidine is sourced from PubChem (CID 58110386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).