2,2-difluoro-2-piperidin-2-ylethanol

C7H13F2NO — CID 146155546

IUPAC2,2-difluoro-2-piperidin-2-ylethanol
SMILESOCC(F)(F)C1CCCCN1
InChIInChI=1S/C7H13F2NO/c8-7(9,5-11)6-3-1-2-4-10-6/h6,10-11H,1-5H2
InChIKeyTXLKHMPALQPCIO-UHFFFAOYSA-N
MW165.18 g/mol
LogP0.76
Rot. Bonds2

About 2,2-difluoro-2-piperidin-2-ylethanol

2,2-difluoro-2-piperidin-2-ylethanol (PubChem CID 146155546) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 2,2-difluoro-2-piperidin-2-ylethanol.

Molecular Properties

Compound Name2,2-difluoro-2-piperidin-2-ylethanol
PubChem CID146155546
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name2,2-difluoro-2-piperidin-2-ylethanol
SMILESOCC(F)(F)C1CCCCN1
InChIInChI=1S/C7H13F2NO/c8-7(9,5-11)6-3-1-2-4-10-6/h6,10-11H,1-5H2
InChIKeyTXLKHMPALQPCIO-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-2-piperidin-2-ylethanol?
The IUPAC name of 2,2-difluoro-2-piperidin-2-ylethanol (CID 146155546) is 2,2-difluoro-2-piperidin-2-ylethanol.
What is the SMILES notation for 2,2-difluoro-2-piperidin-2-ylethanol?
The canonical SMILES for 2,2-difluoro-2-piperidin-2-ylethanol is OCC(F)(F)C1CCCCN1.
What is the InChIKey of 2,2-difluoro-2-piperidin-2-ylethanol?
The InChIKey is TXLKHMPALQPCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9,5-11)6-3-1-2-4-10-6/h6,10-11H,1-5H2.
What are the key properties of 2,2-difluoro-2-piperidin-2-ylethanol?
2,2-difluoro-2-piperidin-2-ylethanol has a molecular weight of 165.18 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-2-piperidin-2-ylethanol is sourced from PubChem (CID 146155546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).