3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol

C9H15F2NO — CID 25057511

IUPAC3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol
SMILESOC1CC(N2CCC(F)(F)CC2)C1
InChIInChI=1S/C9H15F2NO/c10-9(11)1-3-12(4-2-9)7-5-8(13)6-7/h7-8,13H,1-6H2
InChIKeyGAADJWMZBOCZLN-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.24
Rot. Bonds1

About 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol

3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol (PubChem CID 25057511) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol
PubChem CID25057511
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol
SMILESOC1CC(N2CCC(F)(F)CC2)C1
InChIInChI=1S/C9H15F2NO/c10-9(11)1-3-12(4-2-9)7-5-8(13)6-7/h7-8,13H,1-6H2
InChIKeyGAADJWMZBOCZLN-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol?
The IUPAC name of 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol (CID 25057511) is 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol.
What is the SMILES notation for 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol?
The canonical SMILES for 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol is OC1CC(N2CCC(F)(F)CC2)C1.
What is the InChIKey of 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol?
The InChIKey is GAADJWMZBOCZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c10-9(11)1-3-12(4-2-9)7-5-8(13)6-7/h7-8,13H,1-6H2.
What are the key properties of 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol?
3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol has a molecular weight of 191.22 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-difluoropiperidin-1-yl)cyclobutan-1-ol is sourced from PubChem (CID 25057511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).