1-ethyl-4,4-difluoropiperidin-3-ol

C7H13F2NO — CID 130634849

IUPAC1-ethyl-4,4-difluoropiperidin-3-ol
SMILESCCN1CCC(F)(F)C(O)C1
InChIInChI=1S/C7H13F2NO/c1-2-10-4-3-7(8,9)6(11)5-10/h6,11H,2-5H2,1H3
InChIKeyAOCWDYTURBYSRW-UHFFFAOYSA-N
MW165.18 g/mol
LogP0.71
Rot. Bonds1

About 1-ethyl-4,4-difluoropiperidin-3-ol

1-ethyl-4,4-difluoropiperidin-3-ol (PubChem CID 130634849) has the molecular formula C7H13F2NO and a molecular weight of 165.18 g/mol. Its IUPAC name is 1-ethyl-4,4-difluoropiperidin-3-ol.

Molecular Properties

Compound Name1-ethyl-4,4-difluoropiperidin-3-ol
PubChem CID130634849
Molecular FormulaC7H13F2NO
Molecular Weight165.18 g/mol
Exact Mass165.10
IUPAC Name1-ethyl-4,4-difluoropiperidin-3-ol
SMILESCCN1CCC(F)(F)C(O)C1
InChIInChI=1S/C7H13F2NO/c1-2-10-4-3-7(8,9)6(11)5-10/h6,11H,2-5H2,1H3
InChIKeyAOCWDYTURBYSRW-UHFFFAOYSA-N
XLogP0.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.18
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,4-difluoro-1-octylpiperidin-3-ol
CID 138581107
[(3R)-1-ethyl-4,4-difluoropiperidin-3-yl]phosphane
CID 174264008
1-ethyl-3,4-dimethylpiperidin-4-ol
CID 54248940
5-ethyl-5-azaspiro[2.4]heptan-7-ol
CID 59200734
1-ethyl-4-fluoro-4-iodopiperidine
CID 147786451
1-(1-ethylpiperidin-3-yl)cyclopropan-1-ol
CID 115073844
(3S,4R)-1-ethyl-3-fluoropiperidin-4-ol
CID 67202820
1-ethyl-3-fluoropiperidin-4-ol
CID 58266532
3-ethyl-6-methyl-3-azabicyclo[4.1.0]heptane
CID 90707566
1,3-diethylpyrrolidine;ethane
CID 145103245
1-ethyl-4,4-dimethylpyrrolidin-3-ol
CID 121207274
1-ethylpyrrolidin-3-ol;hydrochloride
CID 174666123

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4,4-difluoropiperidin-3-ol?
The IUPAC name of 1-ethyl-4,4-difluoropiperidin-3-ol (CID 130634849) is 1-ethyl-4,4-difluoropiperidin-3-ol.
What is the SMILES notation for 1-ethyl-4,4-difluoropiperidin-3-ol?
The canonical SMILES for 1-ethyl-4,4-difluoropiperidin-3-ol is CCN1CCC(F)(F)C(O)C1.
What is the InChIKey of 1-ethyl-4,4-difluoropiperidin-3-ol?
The InChIKey is AOCWDYTURBYSRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO/c1-2-10-4-3-7(8,9)6(11)5-10/h6,11H,2-5H2,1H3.
What are the key properties of 1-ethyl-4,4-difluoropiperidin-3-ol?
1-ethyl-4,4-difluoropiperidin-3-ol has a molecular weight of 165.18 g/mol, XLogP of 0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4,4-difluoropiperidin-3-ol is sourced from PubChem (CID 130634849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).