3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide

C20H17F2N3O — CID 113028182

IUPAC3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCCc2ccccc2F)cn1)c1cccc(F)c1
InChIInChI=1S/C20H17F2N3O/c21-16-6-3-5-15(12-16)20(26)25-19-9-8-17(13-24-19)23-11-10-14-4-1-2-7-18(14)22/h1-9,12-13,23H,10-11H2,(H,24,25,26)
InChIKeyJMPPLGFGFBANLM-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.27
Rot. Bonds6

About 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide

3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide (PubChem CID 113028182) has the molecular formula C20H17F2N3O and a molecular weight of 353.37 g/mol. Its IUPAC name is 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide
PubChem CID113028182
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC Name3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCCc2ccccc2F)cn1)c1cccc(F)c1
InChIInChI=1S/C20H17F2N3O/c21-16-6-3-5-15(12-16)20(26)25-19-9-8-17(13-24-19)23-11-10-14-4-1-2-7-18(14)22/h1-9,12-13,23H,10-11H2,(H,24,25,26)
InChIKeyJMPPLGFGFBANLM-UHFFFAOYSA-N
XLogP4.27
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.37
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-3-methoxybenzamide
CID 113028185
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-3,4-dimethoxybenzamide
CID 113028190
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-1,3-benzodioxole-5-carboxamide
CID 113028205
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-4-methoxybenzamide
CID 113028186
3-fluoro-N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]benzamide
CID 113028470
N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]-2,6-dimethoxybenzamide
CID 113028188
3-fluoro-N-[5-(3-methoxypropylamino)-2-pyridinyl]benzamide
CID 113025164
2-(4-chlorophenyl)-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]acetamide
CID 113028195
3-fluoro-N-[5-(2-methylpropylamino)-2-pyridinyl]benzamide
CID 113024101
3-fluoro-N-[5-(3-fluoroanilino)-2-pyridinyl]benzamide
CID 113035868
3-chloro-N-[5-[2-(2-methoxyphenyl)ethylamino]-2-pyridinyl]benzamide
CID 113028357
3-fluoro-N-[6-(propylamino)-3-pyridinyl]benzamide
CID 113009042

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide?
The IUPAC name of 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide (CID 113028182) is 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide?
The canonical SMILES for 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide is O=C(Nc1ccc(NCCc2ccccc2F)cn1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide?
The InChIKey is JMPPLGFGFBANLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c21-16-6-3-5-15(12-16)20(26)25-19-9-8-17(13-24-19)23-11-10-14-4-1-2-7-18(14)22/h1-9,12-13,23H,10-11H2,(H,24,25,26).
What are the key properties of 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide?
3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide has a molecular weight of 353.37 g/mol, XLogP of 4.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]benzamide is sourced from PubChem (CID 113028182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).