4-(3,3-difluoropropyl)piperidin-4-ol

C8H15F2NO — CID 90418931

IUPAC4-(3,3-difluoropropyl)piperidin-4-ol
SMILESOC1(CCC(F)F)CCNCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)1-2-8(12)3-5-11-6-4-8/h7,11-12H,1-6H2
InChIKeyUPYVNVMYENAEFO-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.15
Rot. Bonds3

About 4-(3,3-difluoropropyl)piperidin-4-ol

4-(3,3-difluoropropyl)piperidin-4-ol (PubChem CID 90418931) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is 4-(3,3-difluoropropyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(3,3-difluoropropyl)piperidin-4-ol
PubChem CID90418931
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name4-(3,3-difluoropropyl)piperidin-4-ol
SMILESOC1(CCC(F)F)CCNCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)1-2-8(12)3-5-11-6-4-8/h7,11-12H,1-6H2
InChIKeyUPYVNVMYENAEFO-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,3-difluoropropyl)piperidin-4-ol?
The IUPAC name of 4-(3,3-difluoropropyl)piperidin-4-ol (CID 90418931) is 4-(3,3-difluoropropyl)piperidin-4-ol.
What is the SMILES notation for 4-(3,3-difluoropropyl)piperidin-4-ol?
The canonical SMILES for 4-(3,3-difluoropropyl)piperidin-4-ol is OC1(CCC(F)F)CCNCC1.
What is the InChIKey of 4-(3,3-difluoropropyl)piperidin-4-ol?
The InChIKey is UPYVNVMYENAEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c9-7(10)1-2-8(12)3-5-11-6-4-8/h7,11-12H,1-6H2.
What are the key properties of 4-(3,3-difluoropropyl)piperidin-4-ol?
4-(3,3-difluoropropyl)piperidin-4-ol has a molecular weight of 179.21 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-difluoropropyl)piperidin-4-ol is sourced from PubChem (CID 90418931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).