2,2-difluoro-2-piperidin-4-ylethanol

C7H13F2NO — CID 105432620

IUPAC2,2-difluoro-2-piperidin-4-ylethanol
SMILESOCC(F)(F)C1CCNCC1
InChIInChI=1S/C7H13F2NO/c8-7(9,5-11)6-1-3-10-4-2-6/h6,10-11H,1-5H2
InChIKeyGAEOLTATVTXPLM-UHFFFAOYSA-N
MW165.18 g/mol
LogP0.61
Rot. Bonds2

About 2,2-difluoro-2-piperidin-4-ylethanol

2,2-difluoro-2-piperidin-4-ylethanol (PubChem CID 105432620) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 2,2-difluoro-2-piperidin-4-ylethanol.

Molecular Properties

Compound Name2,2-difluoro-2-piperidin-4-ylethanol
PubChem CID105432620
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name2,2-difluoro-2-piperidin-4-ylethanol
SMILESOCC(F)(F)C1CCNCC1
InChIInChI=1S/C7H13F2NO/c8-7(9,5-11)6-1-3-10-4-2-6/h6,10-11H,1-5H2
InChIKeyGAEOLTATVTXPLM-UHFFFAOYSA-N
XLogP0.61
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 ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-difluoro-2-piperidin-4-ylethanamine
CID 105432407
3-cyclopropyl-3,3-difluoropropan-1-ol
CID 105427883
2,2-difluoro-2-(thietan-3-yl)ethanol
CID 105430067
4-(1,1-difluoroethyl)piperidine;hydrochloride
CID 84718975
4-[cyclobutyl(difluoro)methyl]piperidine
CID 105443676
4-(1,1-difluoro-2,2-dimethylpropyl)piperidine;hydrochloride
CID 115058491
3-(1,1-difluoro-3,3-dimethylbutyl)pyrrolidine
CID 115058342
3-(1,1-difluoro-3-methylbutyl)pyrrolidine
CID 105436998
2-amino-3,3-difluoro-3-piperidin-4-ylpropanoic acid
CID 105461470
(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol
CID 171842824
2-piperidin-4-ylpropan-2-yl 3,3-difluorobutanoate
CID 157326852
(3R)-3-(1,1-difluoroethyl)pyrrolidine
CID 154810011

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-2-piperidin-4-ylethanol?
The IUPAC name of 2,2-difluoro-2-piperidin-4-ylethanol (CID 105432620) is 2,2-difluoro-2-piperidin-4-ylethanol.
What is the SMILES notation for 2,2-difluoro-2-piperidin-4-ylethanol?
The canonical SMILES for 2,2-difluoro-2-piperidin-4-ylethanol is OCC(F)(F)C1CCNCC1.
What is the InChIKey of 2,2-difluoro-2-piperidin-4-ylethanol?
The InChIKey is GAEOLTATVTXPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c8-7(9,5-11)6-1-3-10-4-2-6/h6,10-11H,1-5H2.
What are the key properties of 2,2-difluoro-2-piperidin-4-ylethanol?
2,2-difluoro-2-piperidin-4-ylethanol has a molecular weight of 165.18 g/mol, XLogP of 0.61, 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-4-ylethanol is sourced from PubChem (CID 105432620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).