1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol

C11H21FN2O — CID 156720343

IUPAC1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2(F)CCNCC2)CC1
InChIInChI=1S/C11H21FN2O/c12-11(3-5-13-6-4-11)9-14-7-1-10(15)2-8-14/h10,13,15H,1-9H2
InChIKeyIWDKHWKRPCEFRJ-UHFFFAOYSA-N
MW216.30 g/mol
LogP0.53
Rot. Bonds2

About 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol

1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol (PubChem CID 156720343) has the molecular formula C11H21FN2O and a molecular weight of 216.30 g/mol. Its IUPAC name is 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol
PubChem CID156720343
Molecular FormulaC11H21FN2O
Molecular Weight216.30 g/mol
Exact Mass216.16
IUPAC Name1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2(F)CCNCC2)CC1
InChIInChI=1S/C11H21FN2O/c12-11(3-5-13-6-4-11)9-14-7-1-10(15)2-8-14/h10,13,15H,1-9H2
InChIKeyIWDKHWKRPCEFRJ-UHFFFAOYSA-N
XLogP0.53
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.30
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol (CID 156720343) is 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol is OC1CCN(CC2(F)CCNCC2)CC1.
What is the InChIKey of 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol?
The InChIKey is IWDKHWKRPCEFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21FN2O/c12-11(3-5-13-6-4-11)9-14-7-1-10(15)2-8-14/h10,13,15H,1-9H2.
What are the key properties of 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol?
1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol has a molecular weight of 216.30 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluoropiperidin-4-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 156720343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).