4-(difluoromethoxymethyl)piperidine

C7H13F2NO — CID 84717020

IUPAC4-(difluoromethoxymethyl)piperidine
SMILESFC(F)OCC1CCNCC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-5-6-1-3-10-4-2-6/h6-7,10H,1-5H2
InChIKeyRAJXVRBMRBYSEK-UHFFFAOYSA-N
MW165.18 g/mol
LogP1.23
Rot. Bonds3

About 4-(difluoromethoxymethyl)piperidine

4-(difluoromethoxymethyl)piperidine (PubChem CID 84717020) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 4-(difluoromethoxymethyl)piperidine.

Molecular Properties

Compound Name4-(difluoromethoxymethyl)piperidine
PubChem CID84717020
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name4-(difluoromethoxymethyl)piperidine
SMILESFC(F)OCC1CCNCC1
InChIInChI=1S/C7H13F2NO/c8-7(9)11-5-6-1-3-10-4-2-6/h6-7,10H,1-5H2
InChIKeyRAJXVRBMRBYSEK-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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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxymethyl)piperidine?
The IUPAC name of 4-(difluoromethoxymethyl)piperidine (CID 84717020) is 4-(difluoromethoxymethyl)piperidine.
What is the SMILES notation for 4-(difluoromethoxymethyl)piperidine?
The canonical SMILES for 4-(difluoromethoxymethyl)piperidine is FC(F)OCC1CCNCC1.
What is the InChIKey of 4-(difluoromethoxymethyl)piperidine?
The InChIKey is RAJXVRBMRBYSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9)11-5-6-1-3-10-4-2-6/h6-7,10H,1-5H2.
What are the key properties of 4-(difluoromethoxymethyl)piperidine?
4-(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 4-(difluoromethoxymethyl)piperidine is sourced from PubChem (CID 84717020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).