3-(difluoromethoxymethyl)piperidine

C7H13F2NO — CID 58495767

IUPAC3-(difluoromethoxymethyl)piperidine
SMILESFC(F)OCC1CCCNC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-5-6-2-1-3-10-4-6/h6-7,10H,1-5H2
InChIKeyJPLWHENCWSONCD-UHFFFAOYSA-N
MW165.18 g/mol
LogP1.23
Rot. Bonds3

About 3-(difluoromethoxymethyl)piperidine

3-(difluoromethoxymethyl)piperidine (PubChem CID 58495767) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 3-(difluoromethoxymethyl)piperidine.

Molecular Properties

Compound Name3-(difluoromethoxymethyl)piperidine
PubChem CID58495767
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name3-(difluoromethoxymethyl)piperidine
SMILESFC(F)OCC1CCCNC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-5-6-2-1-3-10-4-6/h6-7,10H,1-5H2
InChIKeyJPLWHENCWSONCD-UHFFFAOYSA-N
XLogP1.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Methoxymethyl)piperidine hydrochloride
CID 17178052
3-(Methoxymethyl)piperidine
CID 17178053
(4,4-Difluoropiperidin-3-yl)methanol
CID 67371998
4-((Difluoromethoxy)methyl)piperidine
CID 84717020
3-[(Trifluoromethoxy)methyl]piperidine hydrochloride
CID 122652188
(4-(Trifluoromethyl)piperidin-3-yl)methanol hydrochloride
CID 119031094
(5-Fluoropiperidin-3-YL)methanol
CID 49761292
(4,4-Difluoropiperidin-3-yl)methanol hydrochloride
CID 67371997
2-(Trifluoromethoxy)piperidine
CID 68572157
9,9-Difluoro-3-oxa-7-azabicyclo[3.3.1]nonane
CID 76223011
(5,5-Difluoropiperidin-3-yl)methanol
CID 84072882
(4,4-Difluoro-piperidin-3-yl)-methanol chloride
CID 86657793

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxymethyl)piperidine?
The IUPAC name of 3-(difluoromethoxymethyl)piperidine (CID 58495767) is 3-(difluoromethoxymethyl)piperidine.
What is the SMILES notation for 3-(difluoromethoxymethyl)piperidine?
The canonical SMILES for 3-(difluoromethoxymethyl)piperidine is FC(F)OCC1CCCNC1.
What is the InChIKey of 3-(difluoromethoxymethyl)piperidine?
The InChIKey is JPLWHENCWSONCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9)11-5-6-2-1-3-10-4-6/h6-7,10H,1-5H2.
What are the key properties of 3-(difluoromethoxymethyl)piperidine?
3-(difluoromethoxymethyl)piperidine has a molecular weight of 165.18 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxymethyl)piperidine is sourced from PubChem (CID 58495767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).