2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide

C17H16F2N2O2 — CID 579782

IUPAC2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1F)NCCc1ccccc1F
InChIInChI=1S/C17H16F2N2O2/c18-14-7-3-1-5-12(14)9-10-20-16(22)11-21-17(23)13-6-2-4-8-15(13)19/h1-8H,9-11H2,(H,20,22)(H,21,23)
InChIKeyJUFZERMRZQCQLT-UHFFFAOYSA-N
MW318.32 g/mol
LogP2.05
Rot. Bonds6

About 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide

2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide (PubChem CID 579782) has the molecular formula C17H16F2N2O2 and a molecular weight of 318.32 g/mol. Its IUPAC name is 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
PubChem CID579782
Molecular FormulaC17H16F2N2O2
Molecular Weight318.32 g/mol
Exact Mass318.12
IUPAC Name2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1F)NCCc1ccccc1F
InChIInChI=1S/C17H16F2N2O2/c18-14-7-3-1-5-12(14)9-10-20-16(22)11-21-17(23)13-6-2-4-8-15(13)19/h1-8H,9-11H2,(H,20,22)(H,21,23)
InChIKeyJUFZERMRZQCQLT-UHFFFAOYSA-N
XLogP2.05
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.32
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 4845951
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CID 78792118
2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
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2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide
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4-bromo-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
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CID 2463726
N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112993331
N-[2-(2-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78990913
2-fluoro-N-[2-[[2-(methylamino)acetyl]amino]ethyl]benzamide
CID 119742065
N-[2-(2-fluorophenyl)ethyl]propanamide
CID 22380876
N-[2-[2-(diethylamino)ethylamino]-2-oxoethyl]-2-fluorobenzamide
CID 29369017
5-bromo-2-fluoro-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 24694264

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide (CID 579782) is 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccccc1F)NCCc1ccccc1F.
What is the InChIKey of 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide?
The InChIKey is JUFZERMRZQCQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N2O2/c18-14-7-3-1-5-12(14)9-10-20-16(22)11-21-17(23)13-6-2-4-8-15(13)19/h1-8H,9-11H2,(H,20,22)(H,21,23).
What are the key properties of 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide?
2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide has a molecular weight of 318.32 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 579782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).