(3S)-5-(fluoromethyl)piperidin-3-ol

C6H12FNO — CID 146625758

IUPAC(3S)-5-(fluoromethyl)piperidin-3-ol
SMILESO[C@@H]1CNCC(CF)C1
InChIInChI=1S/C6H12FNO/c7-2-5-1-6(9)4-8-3-5/h5-6,8-9H,1-4H2/t5?,6-/m0/s1
InChIKeyRZPDDUHUZSXOFP-GDVGLLTNSA-N
MW133.17 g/mol
LogP-0.07
Rot. Bonds1

About (3S)-5-(fluoromethyl)piperidin-3-ol

(3S)-5-(fluoromethyl)piperidin-3-ol (PubChem CID 146625758) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is (3S)-5-(fluoromethyl)piperidin-3-ol.

Molecular Properties

Compound Name(3S)-5-(fluoromethyl)piperidin-3-ol
PubChem CID146625758
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name(3S)-5-(fluoromethyl)piperidin-3-ol
SMILESO[C@@H]1CNCC(CF)C1
InChIInChI=1S/C6H12FNO/c7-2-5-1-6(9)4-8-3-5/h5-6,8-9H,1-4H2/t5?,6-/m0/s1
InChIKeyRZPDDUHUZSXOFP-GDVGLLTNSA-N
XLogP-0.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-5-(fluoromethyl)piperidin-3-ol?
The IUPAC name of (3S)-5-(fluoromethyl)piperidin-3-ol (CID 146625758) is (3S)-5-(fluoromethyl)piperidin-3-ol.
What is the SMILES notation for (3S)-5-(fluoromethyl)piperidin-3-ol?
The canonical SMILES for (3S)-5-(fluoromethyl)piperidin-3-ol is O[C@@H]1CNCC(CF)C1.
What is the InChIKey of (3S)-5-(fluoromethyl)piperidin-3-ol?
The InChIKey is RZPDDUHUZSXOFP-GDVGLLTNSA-N. The full InChI is InChI=1S/C6H12FNO/c7-2-5-1-6(9)4-8-3-5/h5-6,8-9H,1-4H2/t5?,6-/m0/s1.
What are the key properties of (3S)-5-(fluoromethyl)piperidin-3-ol?
(3S)-5-(fluoromethyl)piperidin-3-ol has a molecular weight of 133.17 g/mol, XLogP of -0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-5-(fluoromethyl)piperidin-3-ol is sourced from PubChem (CID 146625758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).