2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide

C14H20FN3O — CID 43600344

IUPAC2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCN1CCNCC1
InChIInChI=1S/C14H20FN3O/c15-13-4-2-1-3-12(13)11-14(19)17-7-10-18-8-5-16-6-9-18/h1-4,16H,5-11H2,(H,17,19)
InChIKeyKEPKTLOIFLAHEF-UHFFFAOYSA-N
MW265.33 g/mol
LogP0.39
Rot. Bonds5

About 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide

2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide (PubChem CID 43600344) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide
PubChem CID43600344
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCN1CCNCC1
InChIInChI=1S/C14H20FN3O/c15-13-4-2-1-3-12(13)11-14(19)17-7-10-18-8-5-16-6-9-18/h1-4,16H,5-11H2,(H,17,19)
InChIKeyKEPKTLOIFLAHEF-UHFFFAOYSA-N
XLogP0.39
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-2-piperazin-1-ylacetamide
CID 28505813
4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
2-(2-methylphenyl)-N-(3-piperazin-1-ylpropyl)acetamide
CID 43443368
2-fluoro-N-[3-methyl-1-oxo-1-(2-piperazin-1-ylethylamino)butan-2-yl]benzamide
CID 119445980
2-(2,5-dimethylphenyl)-N-(2-piperazin-1-ylethyl)acetamide
CID 62537843
2-(4-methylphenyl)-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119260061
1-[(2-bromophenyl)methyl]-3-(2-piperazin-1-ylethyl)urea
CID 108897872
N-(2-piperazin-1-ylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119447265
1-[(2-methylphenyl)methyl]-3-(2-piperazin-1-ylethyl)urea
CID 108897157
6-[(2-fluorophenyl)methyl]-5-oxo-N-(2-piperazin-1-ylethyl)thiomorpholine-3-carboxamide
CID 119444906
2,6-dichloro-N-(2-piperazin-1-ylethyl)benzamide
CID 43422024
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide (CID 43600344) is 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide is O=C(Cc1ccccc1F)NCCN1CCNCC1.
What is the InChIKey of 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide?
The InChIKey is KEPKTLOIFLAHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c15-13-4-2-1-3-12(13)11-14(19)17-7-10-18-8-5-16-6-9-18/h1-4,16H,5-11H2,(H,17,19).
What are the key properties of 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide?
2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide has a molecular weight of 265.33 g/mol, XLogP of 0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(2-piperazin-1-ylethyl)acetamide is sourced from PubChem (CID 43600344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).