N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

C17H19FN4O — CID 759034

IUPACN-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1F
InChIInChI=1S/C17H19FN4O/c18-14-5-1-2-6-15(14)20-17(23)13-21-9-11-22(12-10-21)16-7-3-4-8-19-16/h1-8H,9-13H2,(H,20,23)
InChIKeyBZFHBAKYUDMBHE-UHFFFAOYSA-N
MW314.36 g/mol
LogP1.98
Rot. Bonds4

About N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (PubChem CID 759034) has the molecular formula C17H19FN4O and a molecular weight of 314.36 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
PubChem CID759034
Molecular FormulaC17H19FN4O
Molecular Weight314.36 g/mol
Exact Mass314.15
IUPAC NameN-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1F
InChIInChI=1S/C17H19FN4O/c18-14-5-1-2-6-15(14)20-17(23)13-21-9-11-22(12-10-21)16-7-3-4-8-19-16/h1-8H,9-13H2,(H,20,23)
InChIKeyBZFHBAKYUDMBHE-UHFFFAOYSA-N
XLogP1.98
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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4-(2-Pyridyl)piperazine-1-carboxamide
CID 22418783
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-3-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 10884041
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-2-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 11004075
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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (CID 759034) is N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is O=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is BZFHBAKYUDMBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O/c18-14-5-1-2-6-15(14)20-17(23)13-21-9-11-22(12-10-21)16-7-3-4-8-19-16/h1-8H,9-13H2,(H,20,23).
What are the key properties of N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide has a molecular weight of 314.36 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 759034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).