1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride

C10H19ClF2N2O — CID 162726350

IUPAC1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride
SMILESCl.OC1CCN(C2CCNCC2(F)F)CC1
InChIInChI=1S/C10H18F2N2O.ClH/c11-10(12)7-13-4-1-9(10)14-5-2-8(15)3-6-14;/h8-9,13,15H,1-7H2;1H
InChIKeyPSYSLDHPIZAHCU-UHFFFAOYSA-N
MW256.72 g/mol
LogP0.86
Rot. Bonds1

About 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride

1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride (PubChem CID 162726350) has the molecular formula C10H19ClF2N2O and a molecular weight of 256.72 g/mol. Its IUPAC name is 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride.

Molecular Properties

Compound Name1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride
PubChem CID162726350
Molecular FormulaC10H19ClF2N2O
Molecular Weight256.72 g/mol
Exact Mass256.12
IUPAC Name1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride
SMILESCl.OC1CCN(C2CCNCC2(F)F)CC1
InChIInChI=1S/C10H18F2N2O.ClH/c11-10(12)7-13-4-1-9(10)14-5-2-8(15)3-6-14;/h8-9,13,15H,1-7H2;1H
InChIKeyPSYSLDHPIZAHCU-UHFFFAOYSA-N
XLogP0.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.72
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride?
The IUPAC name of 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride (CID 162726350) is 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride.
What is the SMILES notation for 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride?
The canonical SMILES for 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride is Cl.OC1CCN(C2CCNCC2(F)F)CC1.
What is the InChIKey of 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride?
The InChIKey is PSYSLDHPIZAHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O.ClH/c11-10(12)7-13-4-1-9(10)14-5-2-8(15)3-6-14;/h8-9,13,15H,1-7H2;1H.
What are the key properties of 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride?
1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride has a molecular weight of 256.72 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-difluoropiperidin-4-yl)piperidin-4-ol;hydrochloride is sourced from PubChem (CID 162726350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).