1-(trifluoromethylsulfonyl)piperidin-4-ol

C6H10F3NO3S — CID 43502784

IUPAC1-(trifluoromethylsulfonyl)piperidin-4-ol
SMILESO=S(=O)(N1CCC(O)CC1)C(F)(F)F
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-5(11)2-4-10/h5,11H,1-4H2
InChIKeyJUGMTWHWLCCKDM-UHFFFAOYSA-N
MW233.21 g/mol
LogP0.29
Rot. Bonds1

About 1-(trifluoromethylsulfonyl)piperidin-4-ol

1-(trifluoromethylsulfonyl)piperidin-4-ol (PubChem CID 43502784) has the molecular formula C6H10F3NO3S and a molecular weight of 233.21 g/mol. Its IUPAC name is 1-(trifluoromethylsulfonyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(trifluoromethylsulfonyl)piperidin-4-ol
PubChem CID43502784
Molecular FormulaC6H10F3NO3S
Molecular Weight233.21 g/mol
Exact Mass233.03
IUPAC Name1-(trifluoromethylsulfonyl)piperidin-4-ol
SMILESO=S(=O)(N1CCC(O)CC1)C(F)(F)F
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-5(11)2-4-10/h5,11H,1-4H2
InChIKeyJUGMTWHWLCCKDM-UHFFFAOYSA-N
XLogP0.29
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.21
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(trifluoromethylsulfonyl)piperidin-4-ol?
The IUPAC name of 1-(trifluoromethylsulfonyl)piperidin-4-ol (CID 43502784) is 1-(trifluoromethylsulfonyl)piperidin-4-ol.
What is the SMILES notation for 1-(trifluoromethylsulfonyl)piperidin-4-ol?
The canonical SMILES for 1-(trifluoromethylsulfonyl)piperidin-4-ol is O=S(=O)(N1CCC(O)CC1)C(F)(F)F.
What is the InChIKey of 1-(trifluoromethylsulfonyl)piperidin-4-ol?
The InChIKey is JUGMTWHWLCCKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO3S/c7-6(8,9)14(12,13)10-3-1-5(11)2-4-10/h5,11H,1-4H2.
What are the key properties of 1-(trifluoromethylsulfonyl)piperidin-4-ol?
1-(trifluoromethylsulfonyl)piperidin-4-ol has a molecular weight of 233.21 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(trifluoromethylsulfonyl)piperidin-4-ol is sourced from PubChem (CID 43502784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).