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

C11H13F2NO — CID 63588300

IUPAC3-(3,4-difluorophenyl)piperidin-3-ol
SMILESOC1(c2ccc(F)c(F)c2)CCCNC1
InChIInChI=1S/C11H13F2NO/c12-9-3-2-8(6-10(9)13)11(15)4-1-5-14-7-11/h2-3,6,14-15H,1,4-5,7H2
InChIKeyMLXYLFSLDDEIQH-UHFFFAOYSA-N
MW213.23 g/mol
LogP1.54
Rot. Bonds1

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

3-(3,4-difluorophenyl)piperidin-3-ol (PubChem CID 63588300) has the molecular formula C11H13F2NO and a molecular weight of 213.23 g/mol. Its IUPAC name is 3-(3,4-difluorophenyl)piperidin-3-ol.

Molecular Properties

Compound Name3-(3,4-difluorophenyl)piperidin-3-ol
PubChem CID63588300
Molecular FormulaC11H13F2NO
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name3-(3,4-difluorophenyl)piperidin-3-ol
SMILESOC1(c2ccc(F)c(F)c2)CCCNC1
InChIInChI=1S/C11H13F2NO/c12-9-3-2-8(6-10(9)13)11(15)4-1-5-14-7-11/h2-3,6,14-15H,1,4-5,7H2
InChIKeyMLXYLFSLDDEIQH-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4-difluorophenyl)piperidin-3-ol?
The IUPAC name of 3-(3,4-difluorophenyl)piperidin-3-ol (CID 63588300) is 3-(3,4-difluorophenyl)piperidin-3-ol.
What is the SMILES notation for 3-(3,4-difluorophenyl)piperidin-3-ol?
The canonical SMILES for 3-(3,4-difluorophenyl)piperidin-3-ol is OC1(c2ccc(F)c(F)c2)CCCNC1.
What is the InChIKey of 3-(3,4-difluorophenyl)piperidin-3-ol?
The InChIKey is MLXYLFSLDDEIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NO/c12-9-3-2-8(6-10(9)13)11(15)4-1-5-14-7-11/h2-3,6,14-15H,1,4-5,7H2.
What are the key properties of 3-(3,4-difluorophenyl)piperidin-3-ol?
3-(3,4-difluorophenyl)piperidin-3-ol has a molecular weight of 213.23 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-difluorophenyl)piperidin-3-ol is sourced from PubChem (CID 63588300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).