(4-fluoropiperidin-4-yl)methanol

C6H12FNO — CID 55300414

IUPAC(4-fluoropiperidin-4-yl)methanol
SMILESOCC1(F)CCNCC1
InChIInChI=1S/C6H12FNO/c7-6(5-9)1-3-8-4-2-6/h8-9H,1-5H2
InChIKeyHMCPBCNFXXRANL-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.07
Rot. Bonds1

About (4-fluoropiperidin-4-yl)methanol

(4-fluoropiperidin-4-yl)methanol (PubChem CID 55300414) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is (4-fluoropiperidin-4-yl)methanol.

Molecular Properties

Compound Name(4-fluoropiperidin-4-yl)methanol
PubChem CID55300414
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name(4-fluoropiperidin-4-yl)methanol
SMILESOCC1(F)CCNCC1
InChIInChI=1S/C6H12FNO/c7-6(5-9)1-3-8-4-2-6/h8-9H,1-5H2
InChIKeyHMCPBCNFXXRANL-UHFFFAOYSA-N
XLogP0.07
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 ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-fluoropiperidin-4-yl)methanol?
The IUPAC name of (4-fluoropiperidin-4-yl)methanol (CID 55300414) is (4-fluoropiperidin-4-yl)methanol.
What is the SMILES notation for (4-fluoropiperidin-4-yl)methanol?
The canonical SMILES for (4-fluoropiperidin-4-yl)methanol is OCC1(F)CCNCC1.
What is the InChIKey of (4-fluoropiperidin-4-yl)methanol?
The InChIKey is HMCPBCNFXXRANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c7-6(5-9)1-3-8-4-2-6/h8-9H,1-5H2.
What are the key properties of (4-fluoropiperidin-4-yl)methanol?
(4-fluoropiperidin-4-yl)methanol 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 (4-fluoropiperidin-4-yl)methanol is sourced from PubChem (CID 55300414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).