5-(difluoromethyl)piperidin-3-ol

C6H11F2NO — CID 126672556

IUPAC5-(difluoromethyl)piperidin-3-ol
SMILESOC1CNCC(C(F)F)C1
InChIInChI=1S/C6H11F2NO/c7-6(8)4-1-5(10)3-9-2-4/h4-6,9-10H,1-3H2
InChIKeyFUZURPUJSIGXBE-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.22
Rot. Bonds1

About 5-(difluoromethyl)piperidin-3-ol

5-(difluoromethyl)piperidin-3-ol (PubChem CID 126672556) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 5-(difluoromethyl)piperidin-3-ol.

Molecular Properties

Compound Name5-(difluoromethyl)piperidin-3-ol
PubChem CID126672556
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name5-(difluoromethyl)piperidin-3-ol
SMILESOC1CNCC(C(F)F)C1
InChIInChI=1S/C6H11F2NO/c7-6(8)4-1-5(10)3-9-2-4/h4-6,9-10H,1-3H2
InChIKeyFUZURPUJSIGXBE-UHFFFAOYSA-N
XLogP0.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)piperidin-3-ol?
The IUPAC name of 5-(difluoromethyl)piperidin-3-ol (CID 126672556) is 5-(difluoromethyl)piperidin-3-ol.
What is the SMILES notation for 5-(difluoromethyl)piperidin-3-ol?
The canonical SMILES for 5-(difluoromethyl)piperidin-3-ol is OC1CNCC(C(F)F)C1.
What is the InChIKey of 5-(difluoromethyl)piperidin-3-ol?
The InChIKey is FUZURPUJSIGXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-6(8)4-1-5(10)3-9-2-4/h4-6,9-10H,1-3H2.
What are the key properties of 5-(difluoromethyl)piperidin-3-ol?
5-(difluoromethyl)piperidin-3-ol has a molecular weight of 151.16 g/mol, XLogP of 0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)piperidin-3-ol is sourced from PubChem (CID 126672556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).