2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol

C12H16F2N2O — CID 19837148

IUPAC2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol
SMILESOCCN1CCN(c2cc(F)ccc2F)CC1
InChIInChI=1S/C12H16F2N2O/c13-10-1-2-11(14)12(9-10)16-5-3-15(4-6-16)7-8-17/h1-2,9,17H,3-8H2
InChIKeyWEQKULLSYUEGKW-UHFFFAOYSA-N
MW242.27 g/mol
LogP1.08
Rot. Bonds3

About 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol

2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol (PubChem CID 19837148) has the molecular formula C12H16F2N2O and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol
PubChem CID19837148
Molecular FormulaC12H16F2N2O
Molecular Weight242.27 g/mol
Exact Mass242.12
IUPAC Name2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol
SMILESOCCN1CCN(c2cc(F)ccc2F)CC1
InChIInChI=1S/C12H16F2N2O/c13-10-1-2-11(14)12(9-10)16-5-3-15(4-6-16)7-8-17/h1-2,9,17H,3-8H2
InChIKeyWEQKULLSYUEGKW-UHFFFAOYSA-N
XLogP1.08
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(5-fluoro-2-nitrosophenyl)piperazin-1-yl]ethanol
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3-[4-(2,5-difluorophenyl)piperazin-1-yl]propan-1-amine
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2-[4-[2-(1-aminoethyl)-4-fluorophenyl]piperazin-1-yl]ethanol
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2-[4-[2-fluoro-4-(hydroxymethyl)phenyl]piperazin-1-yl]ethanol
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2-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]ethanol
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CID 55232505
1-(2,5-difluorophenyl)piperidine
CID 22638080
2-[4-[2-(1-aminoethyl)-4-fluorophenyl]-1,4-diazepan-1-yl]ethanol
CID 107223420
1-[4-(2,5-difluorophenyl)piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 111824467
2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]ethanol
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1-(2,5-difluorophenyl)piperidin-4-ol
CID 141069702
1-(2,5-difluorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-4-(4-nitrophenyl)pyrrole-2,5-dione
CID 110542826

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol (CID 19837148) is 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol is OCCN1CCN(c2cc(F)ccc2F)CC1.
What is the InChIKey of 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol?
The InChIKey is WEQKULLSYUEGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2O/c13-10-1-2-11(14)12(9-10)16-5-3-15(4-6-16)7-8-17/h1-2,9,17H,3-8H2.
What are the key properties of 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol?
2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol has a molecular weight of 242.27 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,5-difluorophenyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 19837148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).