4,4-difluoropiperidine

C5H9F2N — CID 2758352

IUPAC4,4-difluoropiperidine
SMILESFC1(F)CCNCC1
InChIInChI=1S/C5H9F2N/c6-5(7)1-3-8-4-2-5/h8H,1-4H2
InChIKeyMJOUJKDTBGXKIU-UHFFFAOYSA-N
MW121.13 g/mol
LogP1.01
Rot. Bonds

About 4,4-difluoropiperidine

4,4-difluoropiperidine (PubChem CID 2758352) has the molecular formula C5H9F2N and a molecular weight of 121.13 g/mol. Its IUPAC name is 4,4-difluoropiperidine.

Molecular Properties

Compound Name4,4-difluoropiperidine
PubChem CID2758352
Molecular FormulaC5H9F2N
Molecular Weight121.13 g/mol
Exact Mass121.07
IUPAC Name4,4-difluoropiperidine
SMILESFC1(F)CCNCC1
InChIInChI=1S/C5H9F2N/c6-5(7)1-3-8-4-2-5/h8H,1-4H2
InChIKeyMJOUJKDTBGXKIU-UHFFFAOYSA-N
XLogP1.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.13
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoropiperidine?
The IUPAC name of 4,4-difluoropiperidine (CID 2758352) is 4,4-difluoropiperidine.
What is the SMILES notation for 4,4-difluoropiperidine?
The canonical SMILES for 4,4-difluoropiperidine is FC1(F)CCNCC1.
What is the InChIKey of 4,4-difluoropiperidine?
The InChIKey is MJOUJKDTBGXKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2N/c6-5(7)1-3-8-4-2-5/h8H,1-4H2.
What are the key properties of 4,4-difluoropiperidine?
4,4-difluoropiperidine has a molecular weight of 121.13 g/mol, XLogP of 1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoropiperidine is sourced from PubChem (CID 2758352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).