2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide

C20H18FN3O2 — CID 18149345

IUPAC2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1F)NCCc1cccc2cccnc12
InChIInChI=1S/C20H18FN3O2/c21-17-9-2-1-8-16(17)20(26)24-13-18(25)22-12-10-15-6-3-5-14-7-4-11-23-19(14)15/h1-9,11H,10,12-13H2,(H,22,25)(H,24,26)
InChIKeyQFVBFBRRIPMCNY-UHFFFAOYSA-N
MW351.38 g/mol
LogP2.46
Rot. Bonds6

About 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide

2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide (PubChem CID 18149345) has the molecular formula C20H18FN3O2 and a molecular weight of 351.38 g/mol. Its IUPAC name is 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide
PubChem CID18149345
Molecular FormulaC20H18FN3O2
Molecular Weight351.38 g/mol
Exact Mass351.14
IUPAC Name2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1F)NCCc1cccc2cccnc12
InChIInChI=1S/C20H18FN3O2/c21-17-9-2-1-8-16(17)20(26)24-13-18(25)22-12-10-15-6-3-5-14-7-4-11-23-19(14)15/h1-9,11H,10,12-13H2,(H,22,25)(H,24,26)
InChIKeyQFVBFBRRIPMCNY-UHFFFAOYSA-N
XLogP2.46
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.38
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 579782
2-[2-oxo-2-(2-quinolin-8-ylethylamino)ethoxy]-N-(2-quinolin-8-ylethyl)acetamide
CID 78847250
2-phenylsulfanyl-N-(2-quinolin-8-ylethyl)pyridine-3-carboxamide
CID 18285449
2-naphthalen-2-yl-N-(2-quinolin-8-ylethyl)acetamide
CID 51112165
4-butoxy-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide
CID 78836623
2-(4-fluorophenoxy)-N-(2-quinolin-8-ylethyl)acetamide
CID 18149228
3-chloro-N-(2-quinolin-8-ylethyl)propanamide
CID 81427870
N-[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl]-2-fluorobenzamide
CID 4845951
2-(4-methoxyphenyl)-N-(2-quinolin-8-ylethyl)acetamide
CID 18149265
2-fluoro-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 9163327
2-fluoro-N-(quinolin-8-ylmethyl)pyridine-3-carboxamide
CID 107358803
2-fluoro-N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]benzamide
CID 4781382

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide (CID 18149345) is 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide is O=C(CNC(=O)c1ccccc1F)NCCc1cccc2cccnc12.
What is the InChIKey of 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide?
The InChIKey is QFVBFBRRIPMCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O2/c21-17-9-2-1-8-16(17)20(26)24-13-18(25)22-12-10-15-6-3-5-14-7-4-11-23-19(14)15/h1-9,11H,10,12-13H2,(H,22,25)(H,24,26).
What are the key properties of 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide?
2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide has a molecular weight of 351.38 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]benzamide is sourced from PubChem (CID 18149345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).