(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine

C8H15F2N — CID 174261400

IUPAC(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine
SMILESCCN1CCC(F)(F)C[C@H]1C
InChIInChI=1S/C8H15F2N/c1-3-11-5-4-8(9,10)6-7(11)2/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyLEXNLCLBSGDDKZ-SSDOTTSWSA-N
MW163.21 g/mol
LogP2.13
Rot. Bonds1

About (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine

(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine (PubChem CID 174261400) has the molecular formula C8H15F2N and a molecular weight of 163.21 g/mol. Its IUPAC name is (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine.

Molecular Properties

Compound Name(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine
PubChem CID174261400
Molecular FormulaC8H15F2N
Molecular Weight163.21 g/mol
Exact Mass163.12
IUPAC Name(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine
SMILESCCN1CCC(F)(F)C[C@H]1C
InChIInChI=1S/C8H15F2N/c1-3-11-5-4-8(9,10)6-7(11)2/h7H,3-6H2,1-2H3/t7-/m1/s1
InChIKeyLEXNLCLBSGDDKZ-SSDOTTSWSA-N
XLogP2.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.21
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine?
The IUPAC name of (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine (CID 174261400) is (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine.
What is the SMILES notation for (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine?
The canonical SMILES for (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine is CCN1CCC(F)(F)C[C@H]1C.
What is the InChIKey of (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine?
The InChIKey is LEXNLCLBSGDDKZ-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H15F2N/c1-3-11-5-4-8(9,10)6-7(11)2/h7H,3-6H2,1-2H3/t7-/m1/s1.
What are the key properties of (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine?
(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine has a molecular weight of 163.21 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-ethyl-4,4-difluoro-2-methylpiperidine is sourced from PubChem (CID 174261400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).