N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide

C17H20FN5O — CID 43065834

IUPACN-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(c2cnccn2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C17H20FN5O/c18-14-2-1-3-15(12-14)21-17(24)4-7-22-8-10-23(11-9-22)16-13-19-5-6-20-16/h1-3,5-6,12-13H,4,7-11H2,(H,21,24)
InChIKeyQDFBPRTUSIBMHI-UHFFFAOYSA-N
MW329.38 g/mol
LogP1.77
Rot. Bonds5

About N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide

N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide (PubChem CID 43065834) has the molecular formula C17H20FN5O and a molecular weight of 329.38 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide
PubChem CID43065834
Molecular FormulaC17H20FN5O
Molecular Weight329.38 g/mol
Exact Mass329.17
IUPAC NameN-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(c2cnccn2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C17H20FN5O/c18-14-2-1-3-15(12-14)21-17(24)4-7-22-8-10-23(11-9-22)16-13-19-5-6-20-16/h1-3,5-6,12-13H,4,7-11H2,(H,21,24)
InChIKeyQDFBPRTUSIBMHI-UHFFFAOYSA-N
XLogP1.77
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide
CID 33413945
N-(3-fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide
CID 740647
N-(3-methoxyphenyl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18167873
N-(3-fluorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]propanamide;oxalic acid
CID 171154645
N-(3-fluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
CID 43037946
N-(3-acetamidophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 109030558
N-(3-chloro-4-fluorophenyl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18146818
N-(3-fluorophenyl)-3-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)propanamide
CID 33363762
N-(5-fluoro-2-methylphenyl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18167910
N-(3,4-dimethylphenyl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18146820
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18146864
3-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]-N-(3-fluorophenyl)propanamide
CID 78896184

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide (CID 43065834) is N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide is O=C(CCN1CCN(c2cnccn2)CC1)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide?
The InChIKey is QDFBPRTUSIBMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN5O/c18-14-2-1-3-15(12-14)21-17(24)4-7-22-8-10-23(11-9-22)16-13-19-5-6-20-16/h1-3,5-6,12-13H,4,7-11H2,(H,21,24).
What are the key properties of N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide?
N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide has a molecular weight of 329.38 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 43065834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).