1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol

C14H19F2NO — CID 82217054

IUPAC1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol
SMILESCC1CCCCN1CC(O)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO/c1-10-4-2-3-7-17(10)9-14(18)12-8-11(15)5-6-13(12)16/h5-6,8,10,14,18H,2-4,7,9H2,1H3
InChIKeyONZMUWGGZKCDLV-UHFFFAOYSA-N
MW255.31 g/mol
LogP2.87
Rot. Bonds3

About 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol

1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol (PubChem CID 82217054) has the molecular formula C14H19F2NO and a molecular weight of 255.31 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol
PubChem CID82217054
Molecular FormulaC14H19F2NO
Molecular Weight255.31 g/mol
Exact Mass255.14
IUPAC Name1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol
SMILESCC1CCCCN1CC(O)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO/c1-10-4-2-3-7-17(10)9-14(18)12-8-11(15)5-6-13(12)16/h5-6,8,10,14,18H,2-4,7,9H2,1H3
InChIKeyONZMUWGGZKCDLV-UHFFFAOYSA-N
XLogP2.87
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 ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]ethanol
CID 95153941
1-(2,5-difluorophenyl)-2-(3-methylpiperidin-1-yl)ethanol
CID 82217048
(1S)-1-(4-fluorophenyl)-2-[(2R)-2-methylpyrrolidin-1-yl]ethanol
CID 129392359
1-(2,5-difluorophenyl)-3-(2-ethylpiperidin-1-yl)propan-1-ol
CID 82074393
(1R)-1-(2,5-difluorophenyl)-2-[(2S)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]ethanol
CID 95314003
1-(2,5-difluorophenyl)-2-[3-(hydroxymethyl)pyrrolidin-1-yl]ethanol
CID 111442628
1-[2-(2,5-difluorophenyl)ethyl]-2-methylpiperidine
CID 155721139
2-cyclopentyl-1-(2,5-difluorophenyl)ethanol
CID 61101489
(1S)-1-(2,5-difluorophenyl)-2-[(3S)-3-phenylpyrrolidin-1-yl]ethanol
CID 100851245
2-[cyclohexyl(methyl)amino]-1-(2,5-difluorophenyl)ethanol
CID 82217055
1-[2-chloro-2-(3,4-difluorophenyl)ethyl]-2-methylpiperidine
CID 82215703
1-(2,5-difluorophenyl)-3-(3-methylpiperidin-1-yl)propan-1-ol
CID 82074380

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol?
The IUPAC name of 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol (CID 82217054) is 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol is CC1CCCCN1CC(O)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol?
The InChIKey is ONZMUWGGZKCDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO/c1-10-4-2-3-7-17(10)9-14(18)12-8-11(15)5-6-13(12)16/h5-6,8,10,14,18H,2-4,7,9H2,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol?
1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol has a molecular weight of 255.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-(2-methylpiperidin-1-yl)ethanol is sourced from PubChem (CID 82217054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).