(3,3-difluoropiperidin-4-yl)methanol

C6H11F2NO — CID 55297101

IUPAC(3,3-difluoropiperidin-4-yl)methanol
SMILESOCC1CCNCC1(F)F
InChIInChI=1S/C6H11F2NO/c7-6(8)4-9-2-1-5(6)3-10/h5,9-10H,1-4H2
InChIKeyRDYYKMKTYDTFNJ-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.22
Rot. Bonds1

About (3,3-difluoropiperidin-4-yl)methanol

(3,3-difluoropiperidin-4-yl)methanol (PubChem CID 55297101) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is (3,3-difluoropiperidin-4-yl)methanol.

Molecular Properties

Compound Name(3,3-difluoropiperidin-4-yl)methanol
PubChem CID55297101
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name(3,3-difluoropiperidin-4-yl)methanol
SMILESOCC1CCNCC1(F)F
InChIInChI=1S/C6H11F2NO/c7-6(8)4-9-2-1-5(6)3-10/h5,9-10H,1-4H2
InChIKeyRDYYKMKTYDTFNJ-UHFFFAOYSA-N
XLogP0.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,3-difluoropiperidin-4-yl)methanol?
The IUPAC name of (3,3-difluoropiperidin-4-yl)methanol (CID 55297101) is (3,3-difluoropiperidin-4-yl)methanol.
What is the SMILES notation for (3,3-difluoropiperidin-4-yl)methanol?
The canonical SMILES for (3,3-difluoropiperidin-4-yl)methanol is OCC1CCNCC1(F)F.
What is the InChIKey of (3,3-difluoropiperidin-4-yl)methanol?
The InChIKey is RDYYKMKTYDTFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-6(8)4-9-2-1-5(6)3-10/h5,9-10H,1-4H2.
What are the key properties of (3,3-difluoropiperidin-4-yl)methanol?
(3,3-difluoropiperidin-4-yl)methanol has a molecular weight of 151.16 g/mol, XLogP of 0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluoropiperidin-4-yl)methanol is sourced from PubChem (CID 55297101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).