4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine

C9H18FNO — CID 67170975

IUPAC4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(F)CC(C)(C)N1O
InChIInChI=1S/C9H18FNO/c1-8(2)5-7(10)6-9(3,4)11(8)12/h7,12H,5-6H2,1-4H3
InChIKeyHXVBSERFSFQFMP-UHFFFAOYSA-N
MW175.25 g/mol
LogP2.37
Rot. Bonds

About 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine

4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine (PubChem CID 67170975) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine
PubChem CID67170975
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(F)CC(C)(C)N1O
InChIInChI=1S/C9H18FNO/c1-8(2)5-7(10)6-9(3,4)11(8)12/h7,12H,5-6H2,1-4H3
InChIKeyHXVBSERFSFQFMP-UHFFFAOYSA-N
XLogP2.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine (CID 67170975) is 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine is CC1(C)CC(F)CC(C)(C)N1O.
What is the InChIKey of 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine?
The InChIKey is HXVBSERFSFQFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-8(2)5-7(10)6-9(3,4)11(8)12/h7,12H,5-6H2,1-4H3.
What are the key properties of 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine?
4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine has a molecular weight of 175.25 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-hydroxy-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 67170975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).