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

C6H11F2NO — CID 67371998

IUPAC(4,4-difluoropiperidin-3-yl)methanol
SMILESOCC1CNCCC1(F)F
InChIInChI=1S/C6H11F2NO/c7-6(8)1-2-9-3-5(6)4-10/h5,9-10H,1-4H2
InChIKeyXTGWMTQKEVTLQD-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.22
Rot. Bonds1

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

(4,4-difluoropiperidin-3-yl)methanol (PubChem CID 67371998) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is (4,4-difluoropiperidin-3-yl)methanol.

Molecular Properties

Compound Name(4,4-difluoropiperidin-3-yl)methanol
PubChem CID67371998
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name(4,4-difluoropiperidin-3-yl)methanol
SMILESOCC1CNCCC1(F)F
InChIInChI=1S/C6H11F2NO/c7-6(8)1-2-9-3-5(6)4-10/h5,9-10H,1-4H2
InChIKeyXTGWMTQKEVTLQD-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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Related Compounds

4-Piperidineethanol
CID 73953
Piperidin-3-ylmethanol
CID 107308
3-(Hydroxymethyl)piperidin-4-ol
CID 10419215
(3S)-piperidin-3-ylmethanol
CID 853002
(5-Methylpiperidin-3-yl)methanol
CID 19019558
(4-Methylpiperidin-3-yl)methanol
CID 21825419
3-[(Difluoromethoxy)methyl]piperidine
CID 58495767
5-(Hydroxymethyl)piperidinyl methanol hydrocloride
CID 69756710
3-[(Trifluoromethoxy)methyl]piperidine hydrochloride
CID 122652188
[(3R,5R)-5-methylpiperidin-3-yl]methanol
CID 124547039
2,2,2-Trifluoro-1-(piperidin-3-yl)ethan-1-ol
CID 50990579
(3-Fluoropiperidin-3-yl)methanol hydrochloride
CID 71742825

Frequently Asked Questions

What is the IUPAC name of (4,4-difluoropiperidin-3-yl)methanol?
The IUPAC name of (4,4-difluoropiperidin-3-yl)methanol (CID 67371998) is (4,4-difluoropiperidin-3-yl)methanol.
What is the SMILES notation for (4,4-difluoropiperidin-3-yl)methanol?
The canonical SMILES for (4,4-difluoropiperidin-3-yl)methanol is OCC1CNCCC1(F)F.
What is the InChIKey of (4,4-difluoropiperidin-3-yl)methanol?
The InChIKey is XTGWMTQKEVTLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c7-6(8)1-2-9-3-5(6)4-10/h5,9-10H,1-4H2.
What are the key properties of (4,4-difluoropiperidin-3-yl)methanol?
(4,4-difluoropiperidin-3-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 (4,4-difluoropiperidin-3-yl)methanol is sourced from PubChem (CID 67371998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).