1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol

C14H19F2NO — CID 110897208

IUPAC1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol
SMILESCC1CCN(CC(O)c2c(F)cccc2F)CC1
InChIInChI=1S/C14H19F2NO/c1-10-5-7-17(8-6-10)9-13(18)14-11(15)3-2-4-12(14)16/h2-4,10,13,18H,5-9H2,1H3
InChIKeyOVYGEBGTPKPARV-UHFFFAOYSA-N
MW255.31 g/mol
LogP2.73
Rot. Bonds3

About 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol

1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol (PubChem CID 110897208) has the molecular formula C14H19F2NO and a molecular weight of 255.31 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol
PubChem CID110897208
Molecular FormulaC14H19F2NO
Molecular Weight255.31 g/mol
Exact Mass255.14
IUPAC Name1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol
SMILESCC1CCN(CC(O)c2c(F)cccc2F)CC1
InChIInChI=1S/C14H19F2NO/c1-10-5-7-17(8-6-10)9-13(18)14-11(15)3-2-4-12(14)16/h2-4,10,13,18H,5-9H2,1H3
InChIKeyOVYGEBGTPKPARV-UHFFFAOYSA-N
XLogP2.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,6-difluorophenyl)-2-[4-(2-methylpropoxy)piperidin-1-yl]ethanol
CID 110899763
1-(2,6-difluorophenyl)-2-[4-(1-sulfanylethyl)piperazin-1-yl]ethanol
CID 126759659
1-(2,6-difluorophenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanol
CID 110912986
1-(2,6-difluorophenyl)-2-[4-(4-ethyl-1,2,4-triazol-3-yl)piperidin-1-yl]ethanol
CID 111105329
1-[4-[2-(2,6-difluorophenyl)-2-hydroxyethyl]piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 110897851
1-[(2-fluorophenyl)methyl-methylamino]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 110904922
2-[4-(2-bicyclo[2.2.1]heptanyl)piperazin-1-yl]-1-(2,6-difluorophenyl)ethanol
CID 111701838
1-(2,6-difluorophenyl)-2-[4-(1-methoxypropan-2-yl)piperazin-1-yl]ethanol
CID 111543382
1-(2-fluorophenoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol;hydrochloride
CID 45126222
2-(4-methylpiperidin-1-yl)-1-pyridin-2-ylethanol
CID 82040271
(1S)-1-(2-fluorophenyl)-2-[4-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]ethanol
CID 34179618
2-(aziridin-1-yl)-1-(2-fluorophenyl)ethanol
CID 82125307

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol?
The IUPAC name of 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol (CID 110897208) is 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol.
What is the SMILES notation for 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol?
The canonical SMILES for 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol is CC1CCN(CC(O)c2c(F)cccc2F)CC1.
What is the InChIKey of 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol?
The InChIKey is OVYGEBGTPKPARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO/c1-10-5-7-17(8-6-10)9-13(18)14-11(15)3-2-4-12(14)16/h2-4,10,13,18H,5-9H2,1H3.
What are the key properties of 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol?
1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol has a molecular weight of 255.31 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol is sourced from PubChem (CID 110897208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).