N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide

C19H23FN4O — CID 11530247

IUPACN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
SMILESCCN1CCN(c2ccc(NC(=O)Cc3ccc(F)cc3)cn2)CC1
InChIInChI=1S/C19H23FN4O/c1-2-23-9-11-24(12-10-23)18-8-7-17(14-21-18)22-19(25)13-15-3-5-16(20)6-4-15/h3-8,14H,2,9-13H2,1H3,(H,22,25)
InChIKeySDJBJUOTQUSPSA-UHFFFAOYSA-N
MW342.42 g/mol
LogP2.54
Rot. Bonds5

About N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide

N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide (PubChem CID 11530247) has the molecular formula C19H23FN4O and a molecular weight of 342.42 g/mol. Its IUPAC name is N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
PubChem CID11530247
Molecular FormulaC19H23FN4O
Molecular Weight342.42 g/mol
Exact Mass342.19
IUPAC NameN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
SMILESCCN1CCN(c2ccc(NC(=O)Cc3ccc(F)cc3)cn2)CC1
InChIInChI=1S/C19H23FN4O/c1-2-23-9-11-24(12-10-23)18-8-7-17(14-21-18)22-19(25)13-15-3-5-16(20)6-4-15/h3-8,14H,2,9-13H2,1H3,(H,22,25)
InChIKeySDJBJUOTQUSPSA-UHFFFAOYSA-N
XLogP2.54
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113011060
2-(4-fluorophenyl)-N-[6-(4-pyrimidin-2-ylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 113014545
2-(4-fluorophenyl)-N-[6-(4-formylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 113011137
2-(4-fluorophenyl)-N-[6-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-3-pyridinyl]acetamide
CID 42857339
N-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113014066
2-(4-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 17444414
2-phenyl-N-[6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]-3-pyridinyl]acetamide
CID 155597278
N-[6-[4-(2-hydroxybutyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2-phenylacetamide
CID 42857905
2-(4-ethylpiperazin-1-yl)-N-(6-fluoro-3-pyridinyl)acetamide
CID 167965653
N-(6-pyrrolidin-1-yl-3-pyridinyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 55746212
N-[6-[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 42857454
1-(2-ethoxyphenyl)-3-[6-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-3-pyridinyl]urea
CID 42857738

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide (CID 11530247) is N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide is CCN1CCN(c2ccc(NC(=O)Cc3ccc(F)cc3)cn2)CC1.
What is the InChIKey of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide?
The InChIKey is SDJBJUOTQUSPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O/c1-2-23-9-11-24(12-10-23)18-8-7-17(14-21-18)22-19(25)13-15-3-5-16(20)6-4-15/h3-8,14H,2,9-13H2,1H3,(H,22,25).
What are the key properties of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide?
N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide has a molecular weight of 342.42 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 11530247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).