(6-ethyl-4,4-difluoropiperidin-2-yl)methanol

C8H15F2NO — CID 155607403

IUPAC(6-ethyl-4,4-difluoropiperidin-2-yl)methanol
SMILESCCC1CC(F)(F)CC(CO)N1
InChIInChI=1S/C8H15F2NO/c1-2-6-3-8(9,10)4-7(5-12)11-6/h6-7,11-12H,2-5H2,1H3
InChIKeyYXHWMVFDGQIWJE-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.14
Rot. Bonds2

About (6-ethyl-4,4-difluoropiperidin-2-yl)methanol

(6-ethyl-4,4-difluoropiperidin-2-yl)methanol (PubChem CID 155607403) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is (6-ethyl-4,4-difluoropiperidin-2-yl)methanol.

Molecular Properties

Compound Name(6-ethyl-4,4-difluoropiperidin-2-yl)methanol
PubChem CID155607403
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name(6-ethyl-4,4-difluoropiperidin-2-yl)methanol
SMILESCCC1CC(F)(F)CC(CO)N1
InChIInChI=1S/C8H15F2NO/c1-2-6-3-8(9,10)4-7(5-12)11-6/h6-7,11-12H,2-5H2,1H3
InChIKeyYXHWMVFDGQIWJE-UHFFFAOYSA-N
XLogP1.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-ethyl-4,4-difluoropiperidin-2-yl)methanol?
The IUPAC name of (6-ethyl-4,4-difluoropiperidin-2-yl)methanol (CID 155607403) is (6-ethyl-4,4-difluoropiperidin-2-yl)methanol.
What is the SMILES notation for (6-ethyl-4,4-difluoropiperidin-2-yl)methanol?
The canonical SMILES for (6-ethyl-4,4-difluoropiperidin-2-yl)methanol is CCC1CC(F)(F)CC(CO)N1.
What is the InChIKey of (6-ethyl-4,4-difluoropiperidin-2-yl)methanol?
The InChIKey is YXHWMVFDGQIWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c1-2-6-3-8(9,10)4-7(5-12)11-6/h6-7,11-12H,2-5H2,1H3.
What are the key properties of (6-ethyl-4,4-difluoropiperidin-2-yl)methanol?
(6-ethyl-4,4-difluoropiperidin-2-yl)methanol has a molecular weight of 179.21 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethyl-4,4-difluoropiperidin-2-yl)methanol is sourced from PubChem (CID 155607403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).